Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 4/20 | 0.47 |
| ▸ | BCR | P11274 | 4/20 | 0.47 |
| ▸ | SYK | P43405 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.43 |
| ▸ | IDH2 | P48735 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.40 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL15533631 | 0.85 | ABL1 (0.46) | ABL1BCRMEN1RAB9AKMT2A | |
| SCHEMBL15533795 | 0.85 | ABL1 (0.64) | ABL1BCRMEN1KMT2ATRPV1 | |
| SCHEMBL15533534 | 0.84 | THRB (0.58) | ABL1BCRTRPV1NPSR1ABCG2 | |
| SCHEMBL15533545 | 0.83 | DYRK1A (0.49) | ABL1BCRSYKMEN1NPC1 | |
| SCHEMBL15533525 | 0.81 | MEN1 (0.62) | MEN1NPC1RAB9AKMT2AUSP2 | |
| SCHEMBL15534053 | 0.80 | ABL1 (0.50) | ABL1BCRSYKMEN1NPC1 | |
| SCHEMBL15533662 | 0.80 | CYP2C19 (0.47) | ABL1BCRSYKMEN1NPC1 | |
| SCHEMBL15533691 | 0.80 | MAPT (0.47) | ABL1BCRMEN1NPC1RAB9A | |
| SCHEMBL15534052 | 0.78 | EGFR (0.55) | TRPV1ABCG2USP2LMNACYP2D6 | |
| SCHEMBL15533812 | 0.77 | ALDH1A1 (0.46) | ABL1BCRMEN1NPC1RAB9A |
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 |