Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RXRA | P19793 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18699147 | 0.86 | ELANE (0.32) | — | |
| SCHEMBL13240539 | 0.69 | THRA (0.43) | TLR8CYP1A2CYP2C9CYP2C19RXRA | |
| SCHEMBL17813819 | 0.68 | ALDH1A1 (0.34) | TP53MAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL19040340 | 0.68 | ALDH1A1 (0.34) | KDM4ERXRA | |
| SCHEMBL17808288 | 0.64 | HMGCR (0.32) | — | |
| SCHEMBL12796017 | 0.64 | CA1 (0.31) | CA1CA2 | |
| SCHEMBL13636034 | 0.64 | NOS3 (0.34) | CA1CA2CHRM1 | |
| SCHEMBL19055602 | 0.64 | NPSR1 (0.38) | CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL20091003 | 0.63 | IRAK4 (0.33) | CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL16624018 | 0.63 | SOAT1 (0.44) | TP53MAPTTLR8CYP3A4CYP2D6 |
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-9611248-B2 | Chemical compounds | SYNGENTA LIMITED (GB) | 2017-04-04 | — | — | US | disclosed |