Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR2 | O15552 | 1/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.43 |
| ▸ | ADH5 | P11766 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 7/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 7/20 | 0.42 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3903631 | 0.85 | EGFR (0.57) | SRD5A2S1PR1AKR1C3AKR1C2AKR1C4 | |
| SCHEMBL27702486 | 0.83 | AKR1C3 (0.50) | FFAR2SRD5A2S1PR1ADH5AKR1C3 | |
| SCHEMBL402398 | 0.83 | ADH5 (0.58) | FFAR2SRD5A2S1PR1ADH5AKR1C3 | |
| SCHEMBL27724772 | 0.82 | PDK2 (0.51) | SRD5A2S1PR1AKR1C3AKR1C2 | |
| SCHEMBL403135 | 0.80 | AKR1C3 (0.55) | FFAR2SRD5A2S1PR1ADH5AKR1C3 | |
| SCHEMBL17133900 | 0.80 | AKR1C3 (0.60) | FFAR2SRD5A2S1PR1ADH5AKR1C3 | |
| SCHEMBL28022856 | 0.77 | FFAR2 (0.45) | FFAR2SRD5A2S1PR1ADH5AKR1C3 | |
| SCHEMBL28192342 | 0.77 | PLK1 (0.57) | FFAR2S1PR1AKR1C3AKR1C2S1PR3 | |
| SCHEMBL28098468 | 0.77 | MAPT (0.54) | FFAR2SRD5A2S1PR1ADH5AKR1C3 | |
| SCHEMBL18046185 | 0.75 | MLYCD (0.47) | FFAR2SRD5A2S1PR1ADH5AKR1C3 |
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-105102449-A | Antiviral compounds | HOFFMANN LA ROCHE | 2015-11-25 | — | — | CN | disclosed |