Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.46 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL7375052 | 0.87 | CYP19A1 (0.50) | CYP19A1CYP11B1CYP11B2ALDH1A1CREBBP | |
| SCHEMBL11553968 | 0.82 | CYP19A1 (0.54) | CYP19A1CYP11B1CYP11B2NOTUM | |
| SCHEMBL1065891 | 0.81 | ALDH1A1 (0.62) | CYP19A1CYP11B1CYP11B2ALDH1A1CREBBP | |
| SCHEMBL24991855 | 0.80 | CYP19A1 (0.48) | CYP19A1CYP11B1CYP11B2ALDH1A1CREBBP | |
| SCHEMBL7375050 | 0.79 | ADRA1D (0.48) | CYP19A1CYP11B1CYP11B2ALDH1A1CREBBP | |
| SCHEMBL7368765 | 0.78 | CYP19A1 (0.46) | CYP19A1CYP11B1CYP11B2ALDH1A1NOTUM | |
| SCHEMBL5869934 | 0.76 | HDAC1 (0.55) | CYP19A1ALDH1A1HDAC1HDAC7HDAC3 | |
| SCHEMBL1068209 | 0.76 | CYP19A1 (0.47) | CYP19A1CYP11B1CYP11B2ALDH1A1CREBBP | |
| SCHEMBL3920408 | 0.75 | GRM5 (0.60) | CYP19A1CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL25381660 | 0.75 | ALDH1A1 (0.54) | CYP19A1CYP11B1CYP11B2ALDH1A1CREBBP |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002000651-A2 | FACTOR XA INHIBITORS | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2002-01-03 | — | — | WO | disclosed |