Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | IKBKB | O14920 | 1/20 | 0.44 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.44 |
| ▸ | USP25 | Q9UHP3 | 3/20 | 0.44 |
| ▸ | USP28 | Q96RU2 | 2/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.42 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 2/20 | 0.41 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.40 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.40 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29115473 | 0.86 | P2RX7 (0.45) | USP25USP28P2RX7ACVR1BMPR1B | |
| SCHEMBL29115562 | 0.85 | USP25 (0.44) | USP25USP28P2RX7ACVR1CYP1A2 | |
| Hydrochloric Acid SCHEMBL708308 | 0.83 | PARP1 (0.49) | USP25USP28P2RX7ACVR1ALDH1A1 | |
| SCHEMBL20521486 | 0.83 | ALDH1A1 (0.44) | HTTSMN1; SMN2IKBKBACKR3USP25 | |
| SCHEMBL25093446 | 0.80 | PARP1 (0.48) | HTTIKBKBACVR1CYP1A2ALDH1A1 | |
| SCHEMBL29960481 | 0.80 | PARP1 (0.48) | HTTIKBKBACVR1CYP1A2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL29152389 | 0.79 | PARP1 (0.48) | IKBKBACVR1BMPR1BBMPR1ATGFBR1 | |
| SCHEMBL29960471 | 0.77 | ACVR1 (0.45) | HTTUSP25USP28P2RX7ACVR1 | |
| SCHEMBL29115509 | 0.77 | ACVR1 (0.60) | HTTACVR1CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL5563304 | 0.76 | ALDH1A1 (0.46) | HTTSMN1; SMN2CYP1A2RAD52ALDH1A1 |
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-116710433-A | Selective PARP1 inhibitor and application thereof | 成都百裕制药股份有限公司 | 2023-09-05 | — | — | CN | disclosed |
| WO-2022222966-A1 | SELECTIVE PARP1 INHIBITOR AND APPLICATION THEREOF | 成都百裕制药股份有限公司 | 2022-10-27 | — | — | WO | disclosed |