Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21247480 | 1.00 | ALDH1A1 (0.55) | ALDH1A1KMT2AHSD17B10KDM4EMEN1 | |
| SCHEMBL21253104 | 0.84 | SLC6A3 (0.48) | ALDH1A1KMT2AHSD17B10KDM4EMEN1 | |
| SCHEMBL21247171 | 0.84 | SLC6A3 (0.48) | ALDH1A1KMT2AHSD17B10KDM4EMEN1 | |
| SCHEMBL22769985 | 0.84 | ALDH1A1 (0.46) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL22769987 | 0.84 | ALDH1A1 (0.46) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL21250191 | 0.83 | ALDH1A1 (0.62) | ALDH1A1KMT2AHSD17B10KDM4EMEN1 | |
| SCHEMBL28900482 | 0.78 | CYP1A2 (0.49) | ALDH1A1KMT2AKDM4EMEN1MAPT | |
| SCHEMBL10692987 | 0.75 | CYP19A1 (0.62) | ALDH1A1KMT2AHSD17B10KDM4EMEN1 | |
| SCHEMBL10692983 | 0.75 | CYP19A1 (0.62) | ALDH1A1KMT2AHSD17B10KDM4EMEN1 | |
| Methyl Nicotinate SCHEMBL24566 | 0.73 | ALDH1A1 (1.00) | ALDH1A1KMT2AHSD17B10LMNAL3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111683932-A | Compound with BET inhibition activity, preparation method and application thereof | 上海海和药物研究开发有限公司 | 2020-09-18 | — | — | CN | disclosed |
| WO-2019154329-A1 | COMPOUND HAVING BET INHIBITORY ACTIVITY AND PREPARATION METHOD AND USE THEREFOR | 上海海和药物研究开发有限公司 | 2019-08-15 | — | — | WO | disclosed |