Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.48 |
| ▸ | ABL1 | P00519 | 8/20 | 0.44 |
| ▸ | BCR | P11274 | 7/20 | 0.44 |
| ▸ | SYK | P43405 | 3/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.43 |
| ▸ | TSHR | P16473 | 5/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | PLK4 | O00444 | 1/20 | 0.41 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15533972 | 0.91 | ABL1 (0.53) | ABL1BCRSYKTP53SMN1; SMN2 | |
| SCHEMBL15533691 | 0.84 | MAPT (0.47) | ABL1BCRCLK4CYP1A2CYP3A4 | |
| SCHEMBL15533871 | 0.83 | TP53 (0.51) | ABL1BCRSYKCLK4CYP1A2 | |
| SCHEMBL15533818 | 0.82 | CYP2D6 (0.50) | SYKCLK4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL15533815 | 0.82 | TRPV1 (0.48) | ABL1BCRSYKMAPK1TP53 | |
| SCHEMBL15534259 | 0.81 | TRPV1 (0.57) | ABL1BCRFAAH | |
| SCHEMBL15534453 | 0.80 | TAS2R14 (0.47) | ABL1BCRSYKTP53LMNA | |
| SCHEMBL15534267 | 0.80 | TRPV1 (0.56) | ABL1BCRSYKTP53FAAH | |
| SCHEMBL15534464 | 0.80 | ABL1 (0.46) | ABL1BCRSYKTP53 | |
| SCHEMBL15534101 | 0.79 | TRPV1 (0.47) | ABL1BCRMAPK1TP53FAAH |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013175415-A1 | SUBSTITUTED PYRIMIDINE COMPOUNDS AND USES THEREOF | Piramal Enterprises Limited (IN) | 2013-11-28 | — | — | WO | claimed |
| WO-2013175415-A1 | SUBSTITUTED PYRIMIDINE COMPOUNDS AND USES THEREOF | Piramal Enterprises Limited (IN) | 2013-11-28 | — | — | WO | disclosed |