Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 4/20 | 0.50 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | CHEK2 | O96017 | 7/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | TEK | Q02763 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7810443 | 0.89 | KMT2A (0.45) | GRIN1GRIN2BCYP1A2CYP2E1CYP3A4 | |
| SCHEMBL12909164 | 0.78 | ALDH1A1 (0.63) | GRIN1GRIN2BCYP1A2CYP2E1CYP3A4 | |
| SCHEMBL19190854 | 0.76 | CHEK2 (0.64) | CHEK2ALDH1A1HPGDKDM4ENPC1 | |
| SCHEMBL15294544 | 0.75 | NPSR1 (0.61) | CYP1A2CYP2C9KDRALDH1A1KDM4E | |
| SCHEMBL27203397 | 0.75 | CHEK2 (0.52) | GRIN1GRIN2BCYP1A2CYP2E1CYP3A4 | |
| SCHEMBL25931657 | 0.75 | CHEK2 (0.59) | GRIN1GRIN2BCYP1A2CYP2E1CYP3A4 | |
| SCHEMBL24953738 | 0.74 | KDM4E (0.60) | GRIN1GRIN2BCYP1A2CYP2E1CYP3A4 | |
| SCHEMBL31206946 | 0.74 | KDM4E (0.60) | GRIN1GRIN2BCYP1A2CYP2E1CYP3A4 | |
| SCHEMBL7806906 | 0.74 | GRIN1 (0.62) | GRIN1GRIN2BCYP1A2CYP2E1CYP3A4 | |
| SCHEMBL7813706 | 0.72 | GRIN1 (0.67) | GRIN1GRIN2BCYP1A2CYP2E1CYP3A4 |
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-5972968-A | INTERLEUKIN INHIBITOR | ADIR ET COMPAGNIE (FR) | 1999-10-26 | — | — | US | disclosed |