Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.45 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HBB | P68871 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL147859 | 0.91 | CYP1A2 (0.54) | CYP1A2CYP2A6PDPK1PLAUTDP1 | |
| SCHEMBL30092846 | 0.91 | CYP1A2 (0.54) | CYP1A2CYP2A6PDPK1PLAUTDP1 | |
| SCHEMBL29611939 | 0.91 | CYP1A2 (0.54) | CYP1A2CYP2A6PDPK1PLAUTDP1 | |
| Ethane SCHEMBL11573254 | 0.86 | CYP1A2 (0.56) | CYP1A2CYP2A6PDPK1PLAUALDH1A1 | |
| SCHEMBL9233302 | 0.83 | CYP1A2 (0.47) | CYP1A2CYP2A6PDPK1PLAUTDP1 | |
| Isoquinoline SCHEMBL5507755 | 0.77 | MAPT (0.46) | CYP1A2CYP2A6PDPK1PLAUCYP3A4 | |
| Ether SCHEMBL11883533 | 0.77 | CYP1A2 (0.46) | CYP1A2CYP2A6PDPK1PLAUTDP1 | |
| SCHEMBL18769920 | 0.74 | HSD17B10 (0.35) | HSD17B10EGFRHPGDNQO2 | |
| SCHEMBL18769955 | 0.74 | L3MBTL1 (0.31) | NPC1MAPT | |
| SCHEMBL2749215 | 0.74 | ABL1 (0.47) | CYP1A2CYP2A6PLAUALDH1A1CYP3A4 |
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-6001517-A | A THERMOSETTING POLYMER WHICH CAN BE CURED THROUGH CYCLODEHYDRATION UPON HEATING AND A CURE ACCELERATOR WHICH CAN BE DEACTIVATED OF ITS CURE ACCELERATION PROPERTY BY IRRIDIATION OF LIGHT | KABUSHIKI KAISHA TOSHIBA (JP) | 1999-12-14 | — | — | US | claimed |
| US-6001517-A | A THERMOSETTING POLYMER WHICH CAN BE CURED THROUGH CYCLODEHYDRATION UPON HEATING AND A CURE ACCELERATOR WHICH CAN BE DEACTIVATED OF ITS CURE ACCELERATION PROPERTY BY IRRIDIATION OF LIGHT | KABUSHIKI KAISHA TOSHIBA (JP) | 1999-12-14 | — | — | US | disclosed |