Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 3/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.43 |
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | ADRB3 | P13945 | 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 | |
|---|---|---|---|---|
| SCHEMBL8938113 | 0.84 | SMN1; SMN2 (0.53) | KCNA5KCNH2CYP19A1CFTRSLC6A2 | |
| SCHEMBL2842596 | 0.80 | CFTR (0.57) | KCNA5CYP19A1CFTRSLC6A2SLC6A4 | |
| SCHEMBL27502430 | 0.78 | LMNA (0.57) | SMN1; SMN2USP2ALDH1A1LMNAHPGD | |
| SCHEMBL23565933 | 0.76 | TBXAS1 (0.43) | CFTRSLC6A2SLC6A4SLC6A3GOPC | |
| SCHEMBL15647598 | 0.76 | SMN1; SMN2 (0.62) | KCNA5CFTRSLC6A2SLC6A4SLC6A3 | |
| Ammonia Solution, Strong SCHEMBL5998612 | 0.74 | TBXAS1 (0.43) | CFTRSLC6A2SLC6A4SLC6A3GOPC | |
| SCHEMBL1033928 | 0.74 | CYP19A1 (0.49) | CYP19A1CFTRSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL21889466 | 0.74 | ALDH1A1 (0.55) | KCNH2TAAR1SMN1; SMN2USP2ALDH1A1 | |
| SCHEMBL7678616 | 0.73 | KMT2A (0.46) | KCNA5KCNH2SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL7678624 | 0.71 | AGTR1 (0.46) | TAAR1POLB |
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-3057951-B1 | METHYLENE LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T | JANSSEN PHARMACEUTICA NV (BE) | 2019-11-20 | — | — | EP | disclosed |