Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 3/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 5/20 | 0.42 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.42 |
| ▸ | EP300 | Q09472 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.42 |
| ▸ | UBE2M | P61081 | 1/20 | 0.41 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27675189 | 0.84 | GRIK1 (0.51) | CREBBPRXFP1LMNAMEN1HTT | |
| SCHEMBL27693487 | 0.82 | LMNA (0.51) | CHRM1CREBBPEP300MAOBLMNA | |
| SCHEMBL27675195 | 0.82 | CFD (0.49) | — | |
| SCHEMBL27693567 | 0.82 | CREBBP (0.47) | CHRM1CREBBPEP300MAOBLMNA | |
| SCHEMBL27693586 | 0.81 | MAOB (0.60) | CHRM1CREBBPEP300RXFP1MAOB | |
| SCHEMBL27675227 | 0.81 | CFTR (0.48) | CHRM1CREBBPEP300MAOBLMNA | |
| SCHEMBL27675196 | 0.81 | CREBBP (0.52) | CHRM1CREBBPEP300MAOBLMNA | |
| SCHEMBL27675320 | 0.80 | ALDH1A1 (0.46) | CHRM1CREBBPEP300S1PR1S1PR3 | |
| SCHEMBL27693516 | 0.80 | CREBBP (0.61) | CREBBPEP300RXFP1MAOBKDM4E | |
| SCHEMBL27675135 | 0.80 | CREBBP (0.54) | CHRM1CREBBPEP300MAOBLMNA |
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 |
|---|---|---|---|---|---|---|---|
| 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 |