Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4036235 | 0.80 | SYK (0.44) | MAPK1GRM2TP53HTTHTR1A | |
| SCHEMBL4034266 | 0.74 | MAPT (0.49) | ALDH1A1HSD17B10CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL30853451 | 0.71 | SYK (0.67) | TSHRFFAR1TP53HTTCYP1A2 | |
| SCHEMBL4342702 | 0.71 | SYK (0.67) | TSHRFFAR1TP53HTTCYP1A2 | |
| SCHEMBL224611 | 0.71 | TP53 (0.45) | TSHRALDH1A1ALOX15MAPK1HSD17B10 | |
| SCHEMBL29348719 | 0.71 | ALOX5AP (0.43) | GRM2MAPTHPGDRAB9ANPC1 | |
| SCHEMBL31068341 | 0.71 | ALOX5AP (0.43) | GRM2MAPTHPGDRAB9ANPC1 | |
| Ammonia Solution, Strong SCHEMBL4267568 | 0.70 | SYK (0.65) | TSHRFFAR1TP53HTTCYP1A2 | |
| SCHEMBL668412 | 0.69 | L3MBTL1 (0.52) | TSHRALDH1A1ALOX15MAPK1HSD17B10 | |
| Hydrochloric Acid SCHEMBL27878170 | 0.69 | SYK (0.63) | TSHRFFAR1L3MBTL1TP53HTT |
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-101959889-A | Heterocyclic compounds as inhibitors of CXCR2 | NOVARTIS AG | 2011-01-26 | — | — | CN | disclosed |