Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.58 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.54 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL24914439 | 0.80 | TAS1R3 (0.66) | TAS1R3TAS1R1ALDH1A1TSHRNPSR1 | |
| SCHEMBL29950449 | 0.79 | BCDIN3D (0.51) | TAS1R3TAS1R1ALDH1A1TSHRNPSR1 | |
| SCHEMBL27028480 | 0.79 | BCDIN3D (0.51) | TAS1R3TAS1R1ALDH1A1TSHRNPSR1 | |
| SCHEMBL23115900 | 0.79 | TSHR (0.54) | TAS1R3TAS1R1ALDH1A1TSHRNPSR1 | |
| SCHEMBL29766092 | 0.79 | TSHR (0.54) | TAS1R3TAS1R1ALDH1A1TSHRNPSR1 | |
| SCHEMBL703591 | 0.79 | ALDH1A1 (0.56) | TAS1R3TAS1R1ALDH1A1TSHRNPSR1 | |
| SCHEMBL23985899 | 0.79 | TAS1R3 (0.71) | TAS1R3TAS1R1ALDH1A1TSHRNPSR1 | |
| SCHEMBL30305533 | 0.79 | TAS1R3 (0.71) | TAS1R3TAS1R1ALDH1A1TSHRNPSR1 | |
| SCHEMBL2850378 | 0.79 | EZH2 (0.46) | ALDH1A1HPGDHTTTP53MAPT | |
| SCHEMBL23115839 | 0.78 | ALDH1A1 (0.64) | TAS1R3TAS1R1ALDH1A1TSHRNPSR1 |
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-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | disclosed |