Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | FABP3 | P05413 | 1/20 | 0.33 |
| ▸ | FABP4 | P15090 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.32 |
| ▸ | PTGFR | P43088 | 1/20 | 0.32 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11731518 | 0.90 | TSHR (0.40) | CYP1A2CYP2C19TDP1HPGDKMT2A | |
| SCHEMBL11733336 | 0.86 | CYP1A2 (0.48) | CYP1A2GAACYP2C19TDP1HPGD | |
| SCHEMBL11732616 | 0.85 | GRM2 (0.33) | TBXA2RPTGER1PTGFRPTGER3PTGDR | |
| SCHEMBL11727616 | 0.83 | LTA4H (0.39) | MEN1KMT2ASMN1; SMN2ABCB1TBXA2R | |
| SCHEMBL11732519 | 0.81 | CYP1A2 (0.43) | CYP1A2GAACYP2C19TDP1HPGD | |
| SCHEMBL11732510 | 0.81 | CYP1A2 (0.43) | CYP1A2GAACYP2C19TDP1HPGD | |
| SCHEMBL11725298 | 0.81 | CYP1A2 (0.45) | CYP1A2GAACYP2C19TDP1HPGD | |
| SCHEMBL11726216 | 0.81 | TSHR (0.42) | TDP1MAPK1ALDH1A1TBXA2RPTGER1 | |
| SCHEMBL11731325 | 0.81 | ADRB2 (0.40) | HPGDMEN1KMT2ASMN1; SMN2TBXA2R | |
| SCHEMBL11728656 | 0.80 | TBXA2R (0.37) | TBXA2RPTGER1PTGFRPTGER3PTGDR |
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-4055596-A | PHARMACEUTICALS | MERCK & CO., INC. (US) | 1977-10-25 | — | — | US | disclosed |
| US-3991106-A | FOR ESTRUS SYNCHRONIZATION AND TREATMENT OF INFERTILITY | MERCK & CO., INC. (US) | 1976-11-09 | — | — | US | disclosed |