Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.40 |
| ▸ | CCR9 | P51686 | 2/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.34 |
| ▸ | SCN7A | Q01118 | 2/20 | 0.34 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 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 | |
|---|---|---|---|---|
| SCHEMBL16168681 | 0.88 | CYP2A6 (0.47) | ACSS2CYP2A6CYP11B2CYP11B1CCR9 | |
| SCHEMBL7220183 | 0.85 | CYP11B2 (0.43) | ACSS2CYP2A6CYP11B2CYP11B1CCR9 | |
| SCHEMBL7435149 | 0.85 | ACSS2 (0.44) | ACSS2CYP2A6CYP11B2CYP11B1CCR9 | |
| SCHEMBL27401589 | 0.85 | PPARG (0.43) | ACSS2CYP2A6CYP11B2CYP11B1CCR9 | |
| SCHEMBL7491601 | 0.80 | CYP11B2 (0.46) | ACSS2CYP2A6CYP11B2CYP11B1CCR9 | |
| Bromide SCHEMBL7386963 | 0.76 | ACSS2 (0.43) | ACSS2CYP2A6CYP11B2CYP11B1CCR9 | |
| SCHEMBL7490683 | 0.76 | HRH3 (0.50) | HRH3SCN7AKCNH2 | |
| SCHEMBL10022331 | 0.76 | ACSS2 (0.44) | ACSS2CYP2A6CYP11B2CYP11B1CCR9 | |
| SCHEMBL7491878 | 0.75 | SLC6A4 (0.38) | ACSS2CYP11B2CYP11B1CCR9HRH3 | |
| SCHEMBL7491888 | 0.75 | SLC6A4 (0.38) | ACSS2CYP11B2CYP11B1CCR9HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0918768-B1 | AROMATIC AMIDINE DERIVATIVES USEFUL AS SELECTIVE THROMBIN INHIBITORS | C & C RES LAB (KR) | 2002-01-09 | — | — | EP | disclosed |
| US-6201006-B1 | ANTICOAGULANTS | C & C RESEARCH LABORATORIES (KR) | 2001-03-13 | — | — | US | disclosed |