Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.45 |
| ▸ | NQO1 | P15559 | 4/20 | 0.44 |
| ▸ | CTRC | Q99895 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.40 |
| ▸ | PTGFR | P43088 | 1/20 | 0.40 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.40 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.40 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.40 |
| ▸ | CETP | P11597 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16149017 | 0.80 | CYP1A2 (0.47) | NQO1CYP1A2TAAR1 | |
| SCHEMBL8829572 | 0.78 | NQO1 (0.45) | ALOX5NQO1CTRCCYP1A2CYP2A6 | |
| SCHEMBL8829542 | 0.78 | PDE10A (0.43) | ALOX5CTRCCYP1A2CYP2A6CETP | |
| SCHEMBL4574327 | 0.77 | NQO1 (0.46) | ALOX5NQO1CTRCCYP1A2CYP2A6 | |
| SCHEMBL16545853 | 0.76 | ESR1 (0.48) | — | |
| SCHEMBL8829523 | 0.76 | ALOX5 (0.43) | ALOX5NQO1CTRCCYP1A2CYP2A6 | |
| SCHEMBL9007498 | 0.76 | PTPN7 (0.50) | CYP1A2TBXA2RPTGER4PTGFRPTGER3 | |
| SCHEMBL9007571 | 0.75 | NR1H4 (0.44) | NQO1CYP1A2TBXA2RPTGER4PTGFR | |
| SCHEMBL14327853 | 0.73 | XIAP (0.39) | TAAR1TBXA2R | |
| SCHEMBL9007533 | 0.72 | PTPN7 (0.49) | NQO1CYP1A2TBXA2RPTGER4PTGFR |
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-5610197-A | NON-INSULIN DEPENDENT DIABETES MELLITUS | WYETH | 1997-03-11 | — | — | US | claimed |
| US-5610197-A | NON-INSULIN DEPENDENT DIABETES MELLITUS | WYETH | 1997-03-11 | — | — | US | disclosed |
| US-5444086-A | Hypoglycemic agents | AMERICAN HOME PRODUCTS CORPORATION (US) | 1995-08-22 | — | — | US | disclosed |