Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 1/20 | 0.47 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 3/20 | 0.44 |
| ▸ | PRKCA | P17252 | 3/20 | 0.44 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.44 |
| ▸ | BCR | P11274 | 2/20 | 0.44 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.44 |
| ▸ | PRKCG | P05129 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27827798 | 0.76 | ABCG2 (0.60) | ADORA3ABCG2ABCB1ABCC1NPC1 | |
| SCHEMBL29715745 | 0.74 | KMT2A (0.63) | CYP3A4LMNACYP1A2ALDH1A1TSHR | |
| SCHEMBL16392156 | 0.73 | ABCG2 (0.61) | CYP3A4LMNACYP1A2ALDH1A1TSHR | |
| SCHEMBL15966767 | 0.73 | NPC1 (0.58) | CYP3A4CYP1A2ABCG2ABCB1ABCC1 | |
| Hydrochloric Acid SCHEMBL15974411 | 0.71 | KMT2A (0.53) | CYP3A4CYP1A2ABCG2ABCB1ABCC1 | |
| SCHEMBL14492972 | 0.71 | AURKA (0.56) | MAPK8MAPK10LMNATSHRL3MBTL1 | |
| SCHEMBL5480344 | 0.71 | ABL1 (0.61) | MAPK8MAPK10LMNATSHRABL1 | |
| SCHEMBL15977020 | 0.71 | NPC1 (0.56) | CYP3A4CYP1A2L3MBTL1ABCG2ABCB1 | |
| SCHEMBL4053006 | 0.71 | CYP3A4 (0.57) | CYP3A4LMNACYP1A2ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL15966748 | 0.70 | NPC1 (0.55) | CYP3A4CYP1A2L3MBTL1ABCG2ABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2078018-A1 | HETEROARYL COMPOUNDS, COMPOSITIONS THEREOF, AND USE THEREOF AS PROTEIN KINASE INHIBITORS | Signal Pharmaceuticals LLC (US) | 2009-07-15 | — | — | EP | disclosed |
| WO-2008051494-A1 | HETEROARYL COMPOUNDS, COMPOSITIONS THEREOF, AND USE THEREOF AS PROTEIN KINASE INHIBITORS | SIGNAL PHARMACEUTICALS, LLC (US) | 2008-05-02 | — | — | WO | disclosed |