Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.32 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.32 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.32 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 5/20 | 0.31 |
| ▸ | RAB9A | P51151 | 5/20 | 0.31 |
| ▸ | MEN1 | O00255 | 4/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL26433114 | 0.84 | NPC1 (0.33) | MAPTDGAT1PKMKCNQ3KCNQ2 | |
| SCHEMBL13209349 | 0.76 | HTR2A (0.45) | MAPTDGAT1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL31035921 | 0.76 | PRKCI (0.55) | MAPTEGFRPKMNPC1RAB9A | |
| SCHEMBL9400551 | 0.76 | PRKCI (0.55) | MAPTEGFRPKMNPC1RAB9A | |
| SCHEMBL24037218 | 0.74 | HTR2A (0.46) | DGAT1NPC1RAB9AHTR2C | |
| SCHEMBL10152400 | 0.74 | KCNH2 (0.53) | MAPTDGAT1PKMNPC1RAB9A | |
| SCHEMBL1464920 | 0.74 | PRKCI (0.58) | MAPTEGFRDGAT1MEN1KMT2A | |
| SCHEMBL25696558 | 0.74 | HTR2C (0.46) | MAPTDGAT1KDM4EALDH1A1HPGD | |
| SCHEMBL26432945 | 0.74 | ALDH1A1 (0.39) | MAPTDGAT1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL23225447 | 0.71 | KCNH2 (0.40) | DGAT1PRKCIKCNH2 |
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-2362874-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | Vertex Pharmaceuticals Incorporated (US) | 2011-09-07 | — | — | EP | disclosed |
| WO-2010054138-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS, INCORPORATED (US) | 2010-05-14 | — | — | WO | disclosed |