Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2865868 | 0.84 | RAB9A (0.43) | LMNACYP1A2CYP3A4MAOAALDH1A1 | |
| SCHEMBL24376040 | 0.83 | ALDH1A1 (0.46) | LMNACYP1A2CYP3A4MAOAALDH1A1 | |
| SCHEMBL4355684 | 0.82 | LMNA (0.46) | LMNACYP1A2CYP3A4MAOAALDH1A1 | |
| SCHEMBL28558147 | 0.82 | ALDH1A1 (0.44) | LMNACYP1A2CYP3A4MAOAALDH1A1 | |
| SCHEMBL1753091 | 0.82 | SMN1; SMN2 (0.53) | LMNAALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL28565106 | 0.81 | SMN1; SMN2 (0.42) | ALDH1A1KDM4EHPGDHSD17B10RAB9A | |
| SCHEMBL31332941 | 0.81 | KDM4E (0.44) | LMNAALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL16028248 | 0.81 | SMN1; SMN2 (0.54) | LMNAALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL7988189 | 0.80 | ADORA2A (0.42) | LMNACYP3A4ALDH1A1TP53 | |
| SCHEMBL843514 | 0.79 | TUBB4A (0.49) | LMNAALDH1A1KDM4EHPGDHSD17B10 |
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-112778311-B | Nitrogen-containing fused ring derivative inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2024-06-04 | — | — | CN | disclosed |
| CN-112778311-A | Nitrogen-containing fused ring derivative inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2021-05-11 | — | — | CN | disclosed |