Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 7/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 6/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.49 |
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8484267 | 0.94 | CYP11B2 (0.47) | CYP11B2CYP11B1CYP19A1CYP2C9CYP17A1 | |
| SCHEMBL8481502 | 0.88 | CYP11B1 (0.40) | CYP11B2CYP11B1CYP19A1CYP2C9CYP17A1 | |
| SCHEMBL8554239 | 0.86 | ABCB11 (0.48) | CYP11B2CYP11B1CYP19A1CYP2C9CYP17A1 | |
| SCHEMBL8479969 | 0.85 | CYP51A1 (0.50) | CYP11B2CYP11B1CYP19A1CYP17A1IDO1 | |
| SCHEMBL10695136 | 0.84 | PTAFR (0.51) | PTAFR | |
| Hydrochloric Acid SCHEMBL8482036 | 0.82 | CYP19A1 (0.47) | CYP11B2CYP11B1CYP19A1CYP17A1IDO1 | |
| SCHEMBL10696517 | 0.81 | KMT2A (0.49) | CYP11B2CYP11B1CYP19A1CYP2C9RAB9A | |
| SCHEMBL5016747 | 0.79 | CHRNA7 (0.57) | KDM4ECYP1A2 | |
| SCHEMBL8481869 | 0.78 | KDM4E (0.53) | CYP11B2CYP11B1CYP19A1CYP2C9IDO1 | |
| SCHEMBL7954714 | 0.78 | TBXAS1 (0.49) | SLC6A2SLC6A3NAMPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5977105-A | Compounds | ASTRA PHARMAEUTICALS LTD. (GB) | 1999-11-02 | — | — | US | disclosed |
| EP-0865431-A2 | COMPOUNDS | Astra Pharmaceuticals Limited (GB) | 1998-09-23 | — | — | EP | disclosed |
| WO-1997020815-A1 | COMPOUNDS | ASTRA PHARMACEUTICALS LTD. (GB) | 1997-06-12 | — | — | WO | disclosed |