Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | TLR4 | O00206 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21751527 | 0.94 | MCL1 (0.49) | MCL1MAPK1PTGS1PTGS2KMT2A | |
| SCHEMBL900888 | 0.94 | MCL1 (0.49) | MCL1MAPK1PTGS1PTGS2KMT2A | |
| SCHEMBL16936484 | 0.92 | MCL1 (0.47) | MCL1MAPK1PTGS1PTGS2KMT2A | |
| SCHEMBL5100465 | 0.79 | MAPK1 (0.44) | MCL1MAPK1CYP1A2RECQLPTGS1 | |
| SCHEMBL13857907 | 0.78 | MAPK1 (0.38) | MCL1MAPK1CYP1A2RECQLPTGS1 | |
| SCHEMBL10305711 | 0.76 | CYP1A2 (0.45) | MCL1MAPK1CYP1A2RECQLPTGS1 | |
| SCHEMBL20942908 | 0.76 | CCR2 (0.38) | MCL1MAPK1PTGS1PTGS2KMT2A | |
| 2-Acetylcyclopentanone SCHEMBL22289653 | 0.76 | — | — | |
| 2-Acetylcyclopentanone SCHEMBL12565037 | 0.76 | — | — | |
| 2-Acetylcyclopentanone SCHEMBL535830 | 0.76 | — | — |
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-112920042-A | Method for preparing alkane carboxylic acid by increasing alkane carbon chain | 北京岳达生物科技有限公司 | 2021-06-08 | — | — | CN | disclosed |
| US-4154851-A | ANTIDEPRESSANTS, ANTIAGRESSIVE AGENTS | SCIENCE UNION ET CIE, SOCIETE FRANCAISE DE RECHERCHE MEDICALE (FR) | 1979-05-15 | — | — | US | disclosed |