Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.42 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.39 |
| ▸ | KLK1 | P06870 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.37 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.37 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7374197 | 0.87 | CYP19A1 (0.51) | CYP19A1CYP11B1CYP11B2ALDH1A1L3MBTL1 | |
| SCHEMBL1065891 | 0.83 | ALDH1A1 (0.62) | CYP19A1CYP11B1CYP11B2ALDH1A1L3MBTL1 | |
| SCHEMBL7375050 | 0.77 | ADRA1D (0.48) | CYP19A1CYP11B1CYP11B2ALDH1A1L3MBTL1 | |
| SCHEMBL7369990 | 0.77 | CYP19A1 (0.46) | CYP19A1CYP11B1CYP11B2ALDH1A1L3MBTL1 | |
| SCHEMBL24991855 | 0.76 | CYP19A1 (0.48) | CYP19A1CYP11B1CYP11B2ALDH1A1CREBBP | |
| SCHEMBL1068209 | 0.75 | CYP19A1 (0.47) | CYP19A1CYP11B1CYP11B2ALDH1A1L3MBTL1 | |
| SCHEMBL2699902 | 0.74 | CYP19A1 (0.52) | CYP19A1CYP11B1CYP11B2ALDH1A1L3MBTL1 | |
| SCHEMBL3920408 | 0.74 | GRM5 (0.60) | CYP19A1CYP11B1CYP11B2ALDH1A1TGFBR1 | |
| SCHEMBL25381660 | 0.74 | ALDH1A1 (0.54) | CYP19A1CYP11B1CYP11B2ALDH1A1CREBBP | |
| SCHEMBL30561635 | 0.74 | 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 |