Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | CYP51A1 | Q16850 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19896651 | 0.84 | TAAR1 (0.39) | KDM4ETAAR1HTR3ATSHRNFKB1 | |
| SCHEMBL4453288 | 0.79 | CYP3A4 (0.37) | CYP51A1CYP3A4CYP19A1CYP17A1CYP11B1 | |
| SCHEMBL1678107 | 0.79 | CYP3A4 (0.37) | CYP51A1CYP3A4CYP19A1CYP17A1CYP11B1 | |
| SCHEMBL610027 | 0.78 | LMNA (0.52) | KDM4ETSHR | |
| SCHEMBL15195448 | 0.78 | LMNA (0.52) | KDM4ETSHR | |
| SCHEMBL6280604 | 0.77 | SMN1; SMN2 (0.50) | CYP51A1CYP19A1CYP17A1SLC6A2SLC6A4 | |
| SCHEMBL21935479 | 0.77 | TAAR1 (0.54) | CYP3A4SLC6A2SLC6A3CYP2C19KDM4E | |
| SCHEMBL24240337 | 0.75 | CYP19A1 (0.41) | CYP3A4CYP19A1KDM4EHSD17B10IDO1 | |
| SCHEMBL15195449 | 0.75 | AOC3 (0.47) | CYP3A4CYP2C19IDO1TSHRNFKB1 | |
| SCHEMBL9644848 | 0.75 | PYCR1 (0.44) | — |
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-20020137152-A1 | Fermentation process for epothilones | KOSAN BIOSCIENCES, INC. | 2002-09-26 | — | — | US | disclosed |