Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 2/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | EP300 | Q09472 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27675185 | 0.88 | CFTR (0.51) | CFTRCHRM1LMNACREBBPMAOB | |
| SCHEMBL27693534 | 0.87 | MAOB (0.50) | CHRM1LMNACREBBPMAOBEP300 | |
| SCHEMBL27693491 | 0.85 | CFTR (0.53) | CFTRCHRM1LMNACREBBPMAOB | |
| SCHEMBL27693563 | 0.85 | HSD17B10 (0.41) | CFTRCHRM1LMNACREBBPMAOB | |
| SCHEMBL27675310 | 0.84 | CHRM1 (0.54) | CFTRCHRM1LMNACREBBPMAOB | |
| SCHEMBL27693546 | 0.84 | LMNA (0.42) | CFTRCHRM1LMNACREBBPEP300 | |
| SCHEMBL27675123 | 0.83 | CHRM1 (0.42) | CHRM1LMNACREBBPMAOBEP300 | |
| SCHEMBL27675227 | 0.82 | CFTR (0.48) | CFTRCHRM1LMNACREBBPMAOB | |
| SCHEMBL27693645 | 0.82 | CHRM1 (0.54) | CHRM1LMNAMEN1KMT2APOLB | |
| SCHEMBL27693487 | 0.81 | LMNA (0.51) | CHRM1LMNACREBBPMAOBEP300 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101891680-B | Modulators of ATP-binding cassette transporters | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2014-10-29 | — | — | CN | disclosed |
| CN-101935301-B | Modulators of ATP-binding cassette transporters | VERTEX PHARMA | 2013-10-16 | — | — | CN | disclosed |
| CN-101006076-B | Modulators of ATP-binding cassette transporters | VERTEX PHARMA | 2010-09-29 | — | — | CN | disclosed |
| CN-101006076-A | Modulators of ATP-binding cassette transporters | VERTEX PHARMA (US) | 2007-07-25 | — | — | CN | disclosed |