Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.50 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.50 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20597773 | 1.00 | PARP10 (0.50) | PARP10PARP15PARP14ALDH1A1LMNA | |
| SCHEMBL3219669 | 0.85 | CAPN1 (0.49) | ALDH1A1KDM4ETSHRMEN1KMT2A | |
| SCHEMBL238387 | 0.85 | CAPN1 (0.49) | ALDH1A1KDM4ETSHRMEN1KMT2A | |
| SCHEMBL17542446 | 0.81 | TACR1 (0.64) | LMNAKDM4ETSHRMEN1KMT2A | |
| SCHEMBL17542447 | 0.81 | TACR1 (0.64) | LMNAKDM4ETSHRMEN1KMT2A | |
| SCHEMBL30006546 | 0.80 | ALDH1A1 (0.52) | PARP10PARP15PARP14ALDH1A1LMNA | |
| SCHEMBL28622709 | 0.78 | ALDH1A1 (0.49) | ALDH1A1KDM4ETSHRMEN1KMT2A | |
| SCHEMBL23201898 | 0.78 | APLNR (0.51) | ALDH1A1MEN1KMT2ATP53 | |
| SCHEMBL23201900 | 0.78 | APLNR (0.51) | ALDH1A1MEN1KMT2ATP53 | |
| SCHEMBL28154279 | 0.78 | HTR2A (0.48) | ALDH1A1MEN1KMT2ATP53 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109963835-B | Preparation method of neotoxin and intermediate thereof | 江苏恒瑞医药股份有限公司 | 2022-10-21 | — | — | CN | disclosed |
| CN-107531680-B | Preparation method of toxin and intermediate thereof | 江苏恒瑞医药股份有限公司 | 2020-09-11 | — | — | CN | disclosed |
| CN-109963835-A | A kind of preparation method of new toxin and its intermediate | 江苏恒瑞医药股份有限公司 | 2019-07-02 | — | — | CN | disclosed |
| US-20190055223-A1 | TOXIN AND METHOD FOR PREPARING INTERMEDIATE THEREOF | SHANGHAI HENGRUI PHARMACEUTICAL CO., LTD. (CN) | 2019-02-21 | — | — | US | disclosed |
| US-20190055223-A1 | TOXIN AND METHOD FOR PREPARING INTERMEDIATE THEREOF | SHANGHAI HENGRUI PHARMACEUTICAL CO., LTD. (CN) | 2019-02-21 | — | — | US | disclosed |
| EP-3421463-A1 | NEW TOXIN AND METHOD FOR PREPARING INTERMEDIATE THEREOF | Jiangsu Hengrui Medicine Co., Ltd. (CN) | 2019-01-02 | — | — | EP | disclosed |
| CN-107531680-A | A kind of preparation method of new toxin and its intermediate | 江苏恒瑞医药股份有限公司 | 2018-01-02 | — | — | CN | disclosed |
| WO-2017144015-A1 | NEW TOXIN AND METHOD FOR PREPARING INTERMEDIATE THEREOF | 江苏恒瑞医药股份有限公司 | 2017-08-31 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20190055223-A1 | TOXIN AND METHOD FOR PREPARING INTERMEDIATE THEREOF | VIP, HABP2, FURIN | PARP10 2959/4885PARP15 2400/4885PARP14 2349/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.