Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.54 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 5/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | CDK4 | P11802 | 2/20 | 0.45 |
| ▸ | CCND1 | P24385 | 2/20 | 0.45 |
| ▸ | MAT2A | P31153 | 1/20 | 0.43 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | CDK2 | P24941 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.42 |
| ▸ | CCNT1 | O60563 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL436095 | 0.82 | KDM4E (0.63) | KDM4EDYRK1AALDH1A1RXFP1HPGD | |
| SCHEMBL2833045 | 0.75 | DAO (0.53) | KDM4EALDH1A1HPGDMEN1HTT | |
| SCHEMBL1772236 | 0.74 | KDM4E (0.65) | KDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL26768225 | 0.73 | KDM4E (0.60) | KDM4EDYRK1AALDH1A1RXFP1HPGD | |
| SCHEMBL29853502 | 0.73 | KDM4E (0.60) | KDM4EDYRK1AALDH1A1RXFP1HPGD | |
| SCHEMBL9225121 | 0.73 | ALDH1A1 (0.60) | KDM4EALDH1A1HPGDNPSR1MEN1 | |
| SCHEMBL7418154 | 0.71 | DYRK1A (0.56) | KDM4EDYRK1AALDH1A1RXFP1HPGD | |
| SCHEMBL16695703 | 0.71 | KDM4E (0.54) | KDM4EALDH1A1RXFP1HPGDNPSR1 | |
| SCHEMBL7250711 | 0.71 | KIF11 (0.65) | KDM4EDYRK1AALDH1A1RXFP1MEN1 | |
| SCHEMBL7028805 | 0.70 | KDM4E (0.60) | KDM4EALDH1A1RXFP1HPGDNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0840732-A1 | SUBSTITUTED BENZOLACTAM COMPOUNDS AS SUBSTANCE P ANTAGONISTS | PFIZER INC. (US) | 1998-05-13 | — | — | EP | disclosed |
| WO-1997003066-A1 | SUBSTITUTED BENZOLACTAM COMPOUNDS AS SUBSTANCE P ANTAGONISTS | PFIZER PHARMACEUTICALS INC. (JP) | 1997-01-30 | — | — | WO | disclosed |