Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 2/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.37 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | ATM | Q13315 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | METAP1 | P53582 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | RAD52 | P43351 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11819535 | 0.88 | PARP10 (0.41) | PGRPARP10PARP11PARP1KDM4E | |
| SCHEMBL11819586 | 0.83 | AKR1B1 (0.40) | PGRPARP10PARP1METAP1 | |
| SCHEMBL11822087 | 0.82 | PDE3B (0.43) | KDM4EHTTMETAP1PDE4ACA1 | |
| SCHEMBL11816933 | 0.79 | HRH3 (0.36) | POLBPDE4AALDH1A1MAOAMAOB | |
| SCHEMBL11816989 | 0.76 | CES1 (0.36) | PGRPDE4ASMN1; SMN2 | |
| SCHEMBL11822427 | 0.76 | PDE4A (0.43) | KDM4ECYP1A2CYP3A4CYP2C19PDE4A | |
| SCHEMBL11813866 | 0.74 | KDM4E (0.33) | PARP10PARP1KDM4EATMHTT | |
| SCHEMBL11817638 | 0.74 | PARP1 (0.40) | PARP10PARP1CYP1A2CYP2C19PDE4A | |
| SCHEMBL11818631 | 0.74 | F7 (0.40) | PGRPARP10PARP1PDE4A | |
| SCHEMBL31634423 | 0.74 | TDP2 (0.40) | PARP10PARP11PARP1PDE4ACA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-3958003-A | HETEROCYCLIC COMPOUND, ANALGESICS CENTRAL NERVOUS SYSTEM DEPRESSANT | SANDOZ LTD. (CH) | 1976-05-18 | — | — | US | disclosed |