Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28021727 | 0.81 | HRH3 (0.40) | POLBCYP2C19CYP1A2RAB9AALDH1A1 | |
| SCHEMBL17154340 | 0.75 | CYP2C19 (0.58) | LTA4HPLA2G2APOLBCYP2C19CYP1A2 | |
| SCHEMBL28021740 | 0.74 | ADORA2A (0.42) | POLBCYP2C19CYP1A2RIPK1RAB9A | |
| SCHEMBL16669003 | 0.74 | MEN1 (0.43) | POLBRAB9AMEN1KMT2AMAPT | |
| SCHEMBL10587244 | 0.74 | POLB (0.43) | POLBCYP2C19CYP1A2GSK3BRIPK1 | |
| SCHEMBL22275961 | 0.73 | CYP1B1 (0.39) | CYP1A2GSK3BRAB9AALDH1A1KDM4E | |
| SCHEMBL76204 | 0.73 | CYP2C19 (0.64) | CYP2C19CYP1A2ALDH1A1MEN1KMT2A | |
| SCHEMBL30643815 | 0.73 | CYP2C19 (0.64) | CYP2C19CYP1A2ALDH1A1MEN1KMT2A | |
| SCHEMBL1369959 | 0.71 | CYP2C19 (0.62) | CYP2C19CYP1A2ALDH1A1MEN1KMT2A | |
| SCHEMBL27861234 | 0.71 | CYP2C19 (0.62) | CYP2C19CYP1A2ALDH1A1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-104768932-A | Heteroaryl inhibitors of PDE4 | TETRA DISCOVERY PARTNERS LLC | 2015-07-08 | — | — | CN | disclosed |