Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL18400323 | 0.89 | MEN1 (0.45) | MAPTLMNAKMT2AMEN1KDM4E | |
| SCHEMBL18400346 | 0.89 | LMNA (0.48) | MAPTLMNAKMT2ACYP1A2NPC1 | |
| SCHEMBL18400324 | 0.83 | HDAC6 (0.41) | MAPTLMNAKMT2ANPC1RAB9A | |
| SCHEMBL12026800 | 0.82 | CFTR (0.60) | MAPTLMNAKMT2ACYP1A2NPC1 | |
| SCHEMBL18400349 | 0.81 | MAOA (0.44) | MAPTLMNAKMT2ACYP1A2NPC1 | |
| SCHEMBL18400383 | 0.80 | HDAC3 (0.42) | MAPTLMNANPC1RAB9AKDM4E | |
| SCHEMBL18400347 | 0.80 | HDAC3 (0.42) | MAPTLMNAKMT2ARAB9AMEN1 | |
| SCHEMBL18400325 | 0.80 | HDAC3 (0.42) | MAPTLMNACYP1A2ABL1CYP3A4 | |
| SCHEMBL18400195 | 0.76 | CFTR (0.40) | MAPTKMT2AMEN1KDM4EHPGD | |
| SCHEMBL18400316 | 0.76 | CFTR (0.38) | KMT2AMEN1KDM4EHPGDMAOA |
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 |
|---|---|---|---|---|---|---|---|
| US-9550761-B2 | Modulators of ATP-binding cassette transporters | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2017-01-24 | — | — | US | disclosed |