Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 4/20 | 0.40 |
| ▸ | IDH1 | O75874 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.35 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.35 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.34 |
| ▸ | TACR1 | P25103 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 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 | |
|---|---|---|---|---|
| SCHEMBL4637847 | 0.86 | ABL1 (0.40) | ABL1IDH1CYP11B1CYP11B2SLC16A3 | |
| SCHEMBL4637989 | 0.84 | ABL1 (0.47) | ABL1CYP11B1CYP11B2CHRM5CYP19A1 | |
| SCHEMBL4638893 | 0.81 | ABL1 (0.44) | ABL1CYP11B1CYP11B2CHRM5GPR139 | |
| SCHEMBL4637714 | 0.79 | IDH1 (0.54) | IDH1CYP19A1ALDH1A1 | |
| SCHEMBL4707915 | 0.79 | IDH1 (0.48) | IDH1CYP19A1ALDH1A1KDR | |
| SCHEMBL6426240 | 0.79 | ABL1 (0.38) | ABL1IDH1CYP11B1CYP11B2SLC16A3 | |
| SCHEMBL4637753 | 0.77 | IDH1 (0.47) | IDH1CYP19A1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4638811 | 0.77 | IDH1 (0.40) | IDH1CYP19A1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4638905 | 0.76 | IDH1 (0.41) | IDH1CYP19A1ALDH1A1KDRMAPT | |
| SCHEMBL5795131 | 0.74 | ABL1 (0.43) | ABL1CYP19A1GPR139TACR1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501808-B1 | TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-07-02 | — | — | EP | disclosed |