Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 6/20 | 1.00 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 1.00 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 1.00 |
| ▸ | TSHR | P16473 | 3/20 | 1.00 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 1.00 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.86 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.75 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.75 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | THRB | P10828 | 1/20 | 0.56 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.54 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Phenanthrene SCHEMBL7643 | 1.00 | CYP2A6 (1.00) | CYP2A6ALDH1A1HSD17B10TSHRTDP1 | |
| Phenanthrene SCHEMBL29477074 | 1.00 | CYP2A6 (1.00) | CYP2A6ALDH1A1HSD17B10TSHRTDP1 | |
| Phenanthrene SCHEMBL8873977 | 1.00 | CYP2A6 (1.00) | CYP2A6ALDH1A1HSD17B10TSHRTDP1 | |
| Phenanthrene SCHEMBL1330750 | 1.00 | CYP2A6 (1.00) | CYP2A6ALDH1A1HSD17B10TSHRTDP1 | |
| Phenanthrene SCHEMBL29358486 | 1.00 | CYP2A6 (1.00) | CYP2A6ALDH1A1HSD17B10TSHRTDP1 | |
| Phenanthrene SCHEMBL30932938 | 1.00 | CYP2A6 (1.00) | CYP2A6ALDH1A1HSD17B10TSHRTDP1 | |
| Phenanthrene SCHEMBL25318236 | 0.96 | CYP2A6 (0.92) | CYP2A6ALDH1A1HSD17B10TSHRTDP1 | |
| Phenanthrene SCHEMBL3859754 | 0.96 | CYP2A6 (0.92) | CYP2A6ALDH1A1HSD17B10TSHRTDP1 | |
| Phenanthrene SCHEMBL6281749 | 0.96 | CYP2A6 (0.92) | CYP2A6ALDH1A1HSD17B10TSHRTDP1 | |
| Phenanthrene SCHEMBL16742390 | 0.96 | CYP2A6 (0.92) | CYP2A6ALDH1A1HSD17B10TSHRTDP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1142192-C | Catalyst system containing reaction product of liquid cilicone and polyamine | 伊奎斯塔化学有限公司 | 2004-03-17 | — | — | CN | disclosed |