Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACVR1 | Q04771 | 3/20 | 0.39 |
| ▸ | HTR6 | P50406 | 4/20 | 0.36 |
| ▸ | USP28 | Q96RU2 | 1/20 | 0.34 |
| ▸ | USP25 | Q9UHP3 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | YWHAG | P61981 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30542904 | 0.99 | ACVR1 (0.38) | ACVR1HTR6USP28USP25KDM4E | |
| Ammonia Solution, Strong SCHEMBL29115506 | 0.99 | ACVR1 (0.38) | ACVR1HTR6USP28USP25KDM4E | |
| SCHEMBL25366356 | 0.79 | HTR6 (0.44) | ACVR1HTR6USP28USP25KDM4E | |
| SCHEMBL5666319 | 0.73 | HTR1A (0.47) | HTR6HSD17B10PARP1TSHRHTR1A | |
| SCHEMBL30046455 | 0.71 | HTR2C (0.41) | HTR6HSD17B10HTTALDH1A1HTR1A | |
| SCHEMBL27675711 | 0.71 | ADRB1 (0.49) | ACVR1HTR6KDM4EHSD17B10MEN1 | |
| Hydrochloric Acid SCHEMBL31349206 | 0.70 | ADRB1 (0.47) | ACVR1HTR6KDM4EHSD17B10MEN1 | |
| SCHEMBL30798658 | 0.70 | ACVR1 (0.45) | ACVR1MAPTPARP1TGFBR1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL27844227 | 0.70 | ADRB1 (0.47) | ACVR1HTR6KDM4EHSD17B10MEN1 | |
| SCHEMBL9283309 | 0.69 | DRD2 (0.52) | HTR6KDM4EHSD17B10PARP1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |