Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | DHODH | Q02127 | 3/20 | 0.45 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | MARS1 | P56192 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.40 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL17142715 | 0.82 | CYP1A2 (0.64) | KMT2AMEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28685999 | 0.79 | PTGER4 (0.56) | KMT2A | |
| SCHEMBL17295125 | 0.76 | SCN9A (0.44) | KMT2AMEN1DHODHSCN9ASCN5A | |
| SCHEMBL17290240 | 0.76 | SCN9A (0.44) | KMT2AMEN1DHODHSCN9ASCN5A | |
| SCHEMBL13365068 | 0.76 | SCN9A (0.44) | DHODHSCN9ASCN5AMAPTALDH1A1 | |
| SCHEMBL29954930 | 0.76 | MEN1 (0.42) | KMT2AMEN1CYP1A2CYP2C19SCN9A | |
| SCHEMBL28709406 | 0.76 | HSD11B1 (0.43) | KMT2AMEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4685142 | 0.73 | SCN9A (0.42) | DHODHSCN9ASMN1; SMN2SCN5AMAPT | |
| SCHEMBL841261 | 0.72 | MEN1 (0.56) | KMT2AMEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1574797 | 0.72 | CYP1A2 (0.63) | KMT2AMEN1CYP1A2CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113354585-A | Synthesis of novel EP4 antagonists and their use in cancer and inflammation | 湖北生物医药产业技术研究院有限公司 | 2021-09-07 | — | — | CN | disclosed |