Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | EGFR | P00533 | 5/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28281136 | 0.79 | EGFR (0.64) | CYP2D6EGFRUSP2CYP1A2CYP2C9 | |
| SCHEMBL28050978 | 0.79 | MET (0.51) | ALDH1A1MAPK1KDM4E | |
| SCHEMBL28158830 | 0.79 | MAOB (0.43) | MAP4K4HTR2CHTR2BPNMTCYP3A4 | |
| SCHEMBL28778933 | 0.77 | PNMT (0.48) | GRM5PNMTCYP3A4 | |
| SCHEMBL4147243 | 0.77 | EGFR (0.60) | EGFRPIK3CDPIK3CAFGFR4 | |
| SCHEMBL28264115 | 0.77 | EGFR (0.49) | EGFRPIK3CDPIK3CAUSP2CYP1A2 | |
| SCHEMBL22315252 | 0.76 | EGFR (0.55) | CYP2D6EGFRPIK3CDPIK3CAFGFR4 | |
| SCHEMBL4412970 | 0.73 | EGFR (0.56) | EGFRPIK3CDPIK3CAMAP4K4CYP1A2 | |
| SCHEMBL3300276 | 0.73 | PNMT (0.65) | PNMTCYP3A4 | |
| SCHEMBL6998128 | 0.73 | EGFR (0.55) | EGFRPIK3CDPIK3CAFGFR4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109641886-A | bicyclic BET bromodomain inhibitors and uses thereof | 康威基内有限公司 | 2019-04-16 | — | — | CN | disclosed |