Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | AGXT | P21549 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9533130 | 0.90 | TSHR (0.50) | TSHRTAAR1MAOBMAOACYP2C19 | |
| SCHEMBL29555309 | 0.83 | TSHR (0.60) | TSHRTAAR1MAOBMAOAIDO1 | |
| SCHEMBL3394136 | 0.77 | CALM1 (0.44) | TSHRTAAR1MAOBMAOACYP2C19 | |
| Oxirane SCHEMBL3317346 | 0.76 | TSHR (0.75) | TSHRTAAR1MAOBMAOAIDO1 | |
| Fluoride SCHEMBL27427280 | 0.76 | TSHR (0.94) | TSHRCYP2C19IDO1LMNAAGXT | |
| Dioxane SCHEMBL8701185 | 0.74 | TSHR (0.71) | TSHRTAAR1MAOBMAOAIDO1 | |
| Fluoride SCHEMBL11189438 | 0.73 | TSHR (0.88) | TSHRCYP2C19IDO1LMNAAGXT | |
| SCHEMBL27380 | 0.73 | TSHR (1.00) | TSHRCYP2C19IDO1LMNAAGXT | |
| SCHEMBL5311581 | 0.73 | TSHR (1.00) | TSHRCYP2C19IDO1LMNAAGXT | |
| Benzene SCHEMBL27997624 | 0.73 | TSHR (1.00) | TSHRCYP2C19IDO1LMNAAGXT |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0561941-A1 | N-SUBSTITUTED LACTAMS USEFUL AS CHOLECYSTOKININ ANTAGONISTS. | SEARLE & CO (US) | 1993-09-29 | — | — | EP | disclosed |
| EP-0251827-B1 | NEW CYCLIC ETHER DERIVATIVES, THEIR PREPARATION AND THEIR USE | Sankyo Company Limited (JP) | 1993-09-15 | — | — | EP | disclosed |
| US-4891363-A | PLATELET ACTIVATING FACTOR ANTAGONISTS | SANKYO COMPANY LIMITED (JP) | 1990-01-02 | — | — | US | disclosed |
| EP-0210804-B1 | PHOSPHATE ESTER DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE | SANKYO COMPANY LIMITED (JP) | 1989-05-10 | — | — | EP | disclosed |
| EP-0251827-A2 | New cyclic ether derivatives, their preparation and their use | Sankyo Company Limited (JP) | 1988-01-07 | — | — | EP | disclosed |
| EP-0210804-A1 | Phosphate ester derivatives, their preparation and their therapeutic use | SANKYO COMPANY LIMITED (JP) | 1987-02-04 | — | — | EP | disclosed |
| US-RE30574-E | PREEMERGENT AND POSTEMERGENT | SHELL OIL COMPANY (US) | 1981-04-14 | — | — | US | disclosed |