Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 4/20 | 0.39 |
| ▸ | PPARA | Q07869 | 3/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | MLNR | O43193 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10385000 | 0.81 | PRKD3 (0.55) | HTR2CDRD3ALDH1A1LMNAMAPK1 | |
| Hydrochloric Acid SCHEMBL10385534 | 0.81 | PRKD3 (0.55) | HTR2CDRD3ALDH1A1LMNAMAPK1 | |
| SCHEMBL9720238 | 0.79 | CES2 (0.42) | HTR2CDRD3PRKD3PRKCGPRKCB | |
| SCHEMBL9720214 | 0.76 | MEN1 (0.54) | ALDH1A1LMNACYP3A4MAPK1HTT | |
| SCHEMBL10385452 | 0.76 | MEN1 (0.54) | ALDH1A1LMNACYP3A4MAPK1HTT | |
| SCHEMBL9720191 | 0.73 | PPARG (0.33) | PPARGPPARA | |
| SCHEMBL10386556 | 0.73 | HSP90AA1 (0.36) | LMNAMAPK1SMN1; SMN2TLR2 | |
| SCHEMBL9618272 | 0.73 | BBOX1 (0.56) | HTT | |
| SCHEMBL9720221 | 0.72 | PLA2G2A (0.38) | ALDH1A1LMNAHTTPRKD3PRKCG | |
| SCHEMBL9720263 | 0.72 | PLA2G2A (0.38) | ALDH1A1LMNAHTTPRKD3PRKCG |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5081245-A | Selective antitumor agents | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1992-01-14 | — | — | US | disclosed |
| EP-0356765-A2 | Carboxylic acid derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1990-03-07 | — | — | EP | disclosed |