Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | PARP1 | P09874 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | RGS12 | O14924 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | APEX1 | P27695 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.45 |
| ▸ | MTOR | P42345 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.45 |
| ▸ | HBB | P68871 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1888975 | 0.77 | POLB (0.62) | POLBNPSR1PARP1MEN1RGS12 | |
| SCHEMBL30517110 | 0.77 | POLB (0.62) | POLBNPSR1PARP1MEN1RGS12 | |
| SCHEMBL7118963 | 0.74 | CDK5 (0.54) | POLBNPSR1PARP1MEN1RGS12 | |
| SCHEMBL10390928 | 0.72 | POLB (0.48) | POLBNPSR1PARP1MEN1RGS12 | |
| SCHEMBL8482582 | 0.70 | KDR (0.48) | POLBNPSR1PARP1MEN1RGS12 | |
| SCHEMBL29532065 | 0.70 | KDR (0.48) | POLBNPSR1PARP1MEN1RGS12 | |
| SCHEMBL22532888 | 0.70 | MEN1 (0.42) | POLBNPSR1PARP1MEN1RGS12 | |
| SCHEMBL11594529 | 0.70 | HKDC1 (0.63) | POLBNPSR1PARP1MEN1RGS12 | |
| SCHEMBL11673649 | 0.69 | CYP1B1 (0.54) | POLBNPSR1PARP1MEN1RGS12 | |
| SCHEMBL3301206 | 0.69 | PARP1 (0.49) | POLBNPSR1PARP1MEN1RGS12 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5109135-A | 2- or 3-aminomethyl-4-amino-3,4-dihydro-2H-1,4-benzoxazine intermediates | STERLING DRUG INC. (US) | 1992-04-28 | — | — | US | disclosed |
| US-5066803-A | Chemical intermediates for analgesics | STERLING DRUG INC. (US) | 1991-11-19 | — | — | US | disclosed |
| WO-1990007505-A1 | 2- AND 3-AMINOMETHYL-6-ARYLCARBONYL-2,3-DIHYDROPYRROLO[1,2,3-de]-1,4-BENZOXAZINES | STERLING DRUG INC. (US) | 1990-07-12 | — | — | WO | disclosed |
| US-4939138-A | 2- and 3-aminomethyl-6-arylcarbonyl-2,3-dihydropyrrolo(1,2,3-DE)-1,4-benzoxazines | STERLING DRUG INC. (US) | 1990-07-03 | — | — | US | disclosed |
| US-4369188-A | DIABETES-RELATED UROGENITAL, VISION, AND NERVOUS SYSTEM DISORDERS; ENZYME INHITITORS | AYERST, MCKENNA & HARRISON INC. (CA) | 1983-01-18 | — | — | US | disclosed |