Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 3/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.40 |
| ▸ | BCR | P11274 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.37 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.37 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.37 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.37 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13626925 | 0.94 | ABL1 (0.40) | ABL1ABCB1BCRNPC1RAB9A | |
| SCHEMBL13626931 | 0.85 | ABL1 (0.42) | ABL1ABCB1BCRNPC1RAB9A | |
| SCHEMBL1126228 | 0.83 | RAB9A (0.38) | ABL1ABCB1BCRNPC1RAB9A | |
| SCHEMBL13626554 | 0.81 | ABL1 (0.45) | ABL1ABCB1BCRNPC1RAB9A | |
| SCHEMBL1126285 | 0.81 | RAB9A (0.38) | ABL1ABCB1BCRNPC1RAB9A | |
| SCHEMBL1126518 | 0.80 | CYP11B1 (0.40) | NPC1RAB9AMAPT | |
| SCHEMBL13626930 | 0.80 | ABL1 (0.42) | ABL1ABCB1BCRNPC1RAB9A | |
| SCHEMBL14212767 | 0.77 | MAOB (0.38) | NPC1RAB9AACVR1FGFR1CYP1A1 | |
| SCHEMBL1126354 | 0.77 | CYP11B1 (0.40) | NPC1RAB9AFGFR1MAPT | |
| SCHEMBL14212761 | 0.75 | MAOB (0.38) | NPC1RAB9AACVR1FGFR1CYP1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009141386-A1 | DERIVATIVES OF QUINOLINES AND QUINOXALINES AS PROTEIN TYROSINE KINASE INHIBITORS | NOVARTIS AG (CH) | 2009-11-26 | — | — | WO | disclosed |