Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.57 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | HTR7 | P34969 | 4/20 | 0.54 |
| ▸ | HRH2 | P25021 | 6/20 | 0.54 |
| ▸ | HRH1 | P35367 | 6/20 | 0.54 |
| ▸ | HTR1A | P08908 | 3/20 | 0.54 |
| ▸ | DRD2 | P14416 | 3/20 | 0.54 |
| ▸ | HTR6 | P50406 | 3/20 | 0.54 |
| ▸ | STS | P08842 | 1/20 | 0.53 |
| ▸ | CNR1 | P21554 | 1/20 | 0.52 |
| ▸ | LTA4H | P09960 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7331718 | 0.89 | HTR1A (0.64) | THRATHRBLMNAHTR7HRH2 | |
| SCHEMBL31006969 | 0.81 | THRB (0.54) | THRATHRBNPC1TP53HPGD | |
| SCHEMBL31007007 | 0.81 | THRB (0.54) | THRATHRBNPC1TP53HPGD | |
| SCHEMBL31006991 | 0.81 | THRB (0.54) | THRATHRBNPC1TP53HPGD | |
| SCHEMBL9320928 | 0.79 | STS (0.66) | LMNASTSCNR1 | |
| SCHEMBL7336224 | 0.79 | THRA (0.58) | THRATHRBNPC1TP53HPGD | |
| SCHEMBL10132964 | 0.78 | TUBB4A (0.63) | NPC1RAB9ALMNAHTR7HTR1A | |
| SCHEMBL20399574 | 0.78 | TP53 (0.53) | NPC1TP53HPGDRAB9ALMNA | |
| SCHEMBL14006284 | 0.78 | EPHX2 (0.60) | THRATHRBTP53HPGDRAB9A | |
| SCHEMBL4134472 | 0.77 | STS (0.67) | HPGDLMNASTSCNR1 |
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-0434365-A2 | HIV protease inhibitors useful for the treatment of aids | MERCK & CO. INC. (US) | 1991-06-26 | — | — | EP | claimed |