Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR1 | Q92633 | 1/20 | 0.45 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.40 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4778824 | 0.83 | LPAR1 (0.42) | LPAR1LPAR5ACHEESR1ESR2 | |
| SCHEMBL4779393 | 0.82 | ESR1 (0.39) | CALM1ESR1ESR2CYP19A1MAPT | |
| SCHEMBL14307181 | 0.77 | TSHR (0.49) | LPAR1LPAR5ESR1ESR2TAS2R14 | |
| SCHEMBL4907903 | 0.76 | PPARG (0.45) | ACHEESR1ESR2MTNR1AMTNR1B | |
| SCHEMBL4907904 | 0.76 | PPARG (0.45) | ACHEESR1ESR2MTNR1AMTNR1B | |
| SCHEMBL13721783 | 0.75 | PPARA (0.51) | CALM1TAS2R14ALDH1A1MAPTTDP1 | |
| SCHEMBL13721910 | 0.71 | PPARA (0.47) | CALM1GAAMAPT | |
| SCHEMBL27772539 | 0.69 | GABRA1 (0.63) | CALM1ESR1ESR2CYP19A1 | |
| SCHEMBL7730448 | 0.68 | HDAC1 (0.45) | TDP1HDAC1HDAC6 | |
| SCHEMBL18393365 | 0.67 | ESR2 (0.69) | ESR1ESR2ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008006044-A2 | SUBSTITUTED ACID DERIVATIVES USEFUL AS ANTIDIABETIC AND ANTIOBESITY AGENTS AND METHOD | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-01-10 | — | — | WO | disclosed |