Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.44 |
| ▸ | RAB9A | P51151 | 5/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | PIN1 | Q13526 | 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 | |
|---|---|---|---|---|
| SCHEMBL1979039 | 0.87 | ALDH1A1 (0.47) | NPC1RAB9AMAPTKMT2AMEN1 | |
| SCHEMBL1979335 | 0.82 | PIN1 (0.37) | KMT2AMEN1MAPK1ALDH1A1HPGD | |
| SCHEMBL1984451 | 0.77 | MAPT (0.41) | NPC1RAB9ARECQLMAPTKMT2A | |
| SCHEMBL1978964 | 0.77 | SCD (0.39) | NPC1RAB9ARECQLMAPTKMT2A | |
| SCHEMBL1340747 | 0.72 | RAB9A (0.83) | NPC1RAB9ARECQLMAPTKMT2A | |
| SCHEMBL3372774 | 0.71 | NPC1 (0.60) | NPC1RAB9ARECQLMAPTKMT2A | |
| SCHEMBL214555 | 0.70 | NPC1 (0.58) | NPC1RAB9ARECQLMAPTKMT2A | |
| SCHEMBL15716580 | 0.70 | S1PR4 (0.51) | NPC1RAB9ARECQLMAPTKMT2A | |
| SCHEMBL10582387 | 0.69 | ALDH1A1 (0.76) | NPC1RAB9ARECQLMAPTKMT2A | |
| SCHEMBL14839601 | 0.69 | ALDH1A1 (0.76) | NPC1RAB9ARECQLMAPTKMT2A |
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-2011070299-A1 | TRI-SUBSTITUTED 9H-BETA-CARBOLINE (OR 9H-PYRIDO[3,4-B]INDOLE) DERIVATIVES, PREPARATION OF SAME AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2011-06-16 | — | — | WO | disclosed |