Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.56 |
| ▸ | BCR | P11274 | 1/20 | 0.56 |
| ▸ | AURKA | O14965 | 1/20 | 0.54 |
| ▸ | TPX2 | Q9ULW0 | 1/20 | 0.54 |
| ▸ | PARP10 | Q53GL7 | 7/20 | 0.53 |
| ▸ | PARP4 | Q9UKK3 | 2/20 | 0.53 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.53 |
| ▸ | PARP16 | Q8N5Y8 | 1/20 | 0.53 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.51 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.50 |
| ▸ | MMP2 | P08253 | 1/20 | 0.50 |
| ▸ | MMP9 | P14780 | 1/20 | 0.50 |
| ▸ | MMP8 | P22894 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL324161 | 0.94 | PARP10 (0.59) | ABL1BCRPARP10PARP4PARP15 | |
| Hydrochloric Acid SCHEMBL3785321 | 0.92 | PARP10 (0.57) | ABL1BCRPARP10PARP4PARP15 | |
| Hydrochloric Acid SCHEMBL11888844 | 0.92 | PARP10 (0.57) | ABL1BCRPARP10PARP4PARP15 | |
| SCHEMBL22740915 | 0.89 | PARP10 (0.53) | ABL1BCRPARP10PARP4PARP15 | |
| SCHEMBL22721342 | 0.89 | PARP10 (0.70) | ABL1BCRPARP10PARP4PARP15 | |
| Pyridine SCHEMBL22372443 | 0.88 | MKNK1 (0.51) | ABL1BCRAURKATPX2PARP10 | |
| SCHEMBL5453961 | 0.84 | ABL1 (0.63) | ABL1BCRPARP10PARP4PARP15 | |
| SCHEMBL3721809 | 0.84 | ABL1 (0.62) | ABL1BCRAURKATPX2SLC6A2 | |
| SCHEMBL505538 | 0.83 | AURKA (0.69) | AURKATPX2ALDH1A1MMP2MMP9 | |
| SCHEMBL22815931 | 0.81 | AURKA (0.54) | AURKATPX2MMP2MMP9MMP8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021049522-A1 | ONIUM SALT OF NITROGEN-CONTAINING HETEROARYL COMPOUND AND PEST CONTROL AGENT | 日本曹達株式会社 | 2021-03-18 | — | — | WO | disclosed |
| CN-104955826-B | It can be used for treating spiral shell-Quinzolone derivatives of neurological disorder and illness | 默克专利股份公司 | 2019-05-31 | — | — | CN | disclosed |
| CN-104379574-B | For suppressing the heterocyclic carbamate derivatives of the activity of ABL1, ABL2 and BCR ABL1 | 诺华股份有限公司 | 2017-03-01 | — | — | CN | disclosed |
| CN-104955826-A | SPIRO-QUINAZOLINONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEUROLOGICAL DISEASES AND CONDITIONS | MERCK PATENT GMBH | 2015-09-30 | — | — | CN | disclosed |
| CN-104379574-A | Benzamide derivatives for inhibiting the activity of ABL1, ABL 2 and BCR-ABL 1 | NOVARTIS AG | 2015-02-25 | — | — | CN | disclosed |
| CN-104302634-A | Benzamide derivatives for inhibiting the activity of ABL1, ABL2 and BCR-ABL1 | NOVARTIS AG | 2015-01-21 | — | — | CN | disclosed |
| CN-104302638-A | Benzamide derivatives for inhibiting the activity of abl1, abl2 and bcr-abl1 | NOVARTIS AG | 2015-01-21 | — | — | CN | disclosed |
| WO-2005014533-A2 | ARYL AND HETEROARYL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE | TRANSTECH PHARMA, INC. (US) | 2005-02-17 | — | — | WO | disclosed |