Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 3/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PHGDH | O43175 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL2306014 | 0.74 | OPRM1 (0.43) | ALDH1A1SMN1; SMN2OPRM1MEN1KMT2A | |
| SCHEMBL11666087 | 0.73 | RAB9A (0.44) | ALDH1A1SMN1; SMN2TSHRNPSR1OPRM1 | |
| SCHEMBL2314113 | 0.73 | OPRM1 (0.42) | ALDH1A1SMN1; SMN2OPRM1MEN1KMT2A | |
| SCHEMBL11624342 | 0.71 | APP (0.52) | ALDH1A1TSHRLMNASLC6A4OPRM1 | |
| SCHEMBL11627747 | 0.70 | TACR1 (0.47) | ALDH1A1SMN1; SMN2TSHROPRM1MEN1 | |
| SCHEMBL3431814 | 0.70 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2TSHRLMNANPSR1 | |
| SCHEMBL3329282 | 0.69 | SMN1; SMN2 (0.40) | ALDH1A1SMN1; SMN2TSHRLMNAMEN1 | |
| SCHEMBL3332841 | 0.69 | SMN1; SMN2 (0.40) | ALDH1A1SMN1; SMN2TSHRLMNAMEN1 | |
| SCHEMBL3329277 | 0.69 | SMN1; SMN2 (0.43) | ALDH1A1SMN1; SMN2TSHRCYP2C9CYP2C19 | |
| SCHEMBL3332875 | 0.69 | SMN1; SMN2 (0.43) | ALDH1A1SMN1; SMN2TSHRCYP2C9CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6365592-B1 | FOR THERAPY OF DIABETES, GLUCOSE INTOLERANCE, INSULIN RESISTANCE, AND OBESITY | MERCK FROSST CANADA & CO. (CA) | 2002-04-02 | — | — | US | disclosed |
| EP-1181309-A1 | PHOSPHONIC AND CARBOXYLIC ACID DERIVATIVES AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE-1B (PTP-1B) | MERCK FROSST CANADA INC. (CA) | 2002-02-27 | — | — | EP | disclosed |
| WO-2000069889-A1 | PHOSPHONIC AND CARBOXYLIC ACID DERIVATIVES AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE-1B (PTP-1B) | MERCK FROSST CANADA & CO. (CA) | 2000-11-23 | — | — | WO | disclosed |