Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.65 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.56 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | KIF11 | P52732 | 1/20 | 0.48 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL598696 | 0.89 | CYP1A2 (0.69) | CYP1A2CYP2A6ALDH1A1HSD17B10HIF1A | |
| SCHEMBL19583369 | 0.89 | CYP2A6 (0.58) | CYP1A2CYP2A6ALDH1A1TSHRKIF11 | |
| SCHEMBL7773085 | 0.88 | CYP1A2 (0.67) | CYP1A2CYP2A6ALDH1A1HSD17B10HIF1A | |
| SCHEMBL1898791 | 0.88 | CYP1A2 (0.67) | CYP1A2CYP2A6ALDH1A1HSD17B10HIF1A | |
| SCHEMBL9765513 | 0.84 | CYP1A2 (0.57) | CYP1A2CYP2A6ALDH1A1HIF1ACYP2D6 | |
| SCHEMBL19583381 | 0.83 | CYP1A2 (0.56) | CYP1A2CYP2A6ALDH1A1HSD17B10HIF1A | |
| Phenanthrene SCHEMBL28839877 | 0.82 | TP53 (0.67) | CYP1A2CYP2A6ALDH1A1HSD17B10HIF1A | |
| SCHEMBL19583366 | 0.80 | CYP1A2 (0.61) | CYP1A2CYP2A6ALDH1A1HSD17B10HIF1A | |
| SCHEMBL28499910 | 0.80 | CYP1A2 (0.53) | CYP1A2CYP2A6ALDH1A1HSD17B10HIF1A | |
| SCHEMBL73386 | 0.79 | CYP2A6 (1.00) | CYP1A2CYP2A6ALDH1A1TDP1SIGMAR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112485343-A | Underground water hydrocarbon pollutant source tracing method and system | 长江大学 | 2021-03-12 | — | — | CN | disclosed |
| CN-109071731-A | Polymerizable composition, polymerizable composition containing reactivity silesquioxane compound containing phenanthrene ring | 日产化学株式会社 | 2018-12-21 | — | — | CN | disclosed |
| US-20170329220-A1 | PHOTOSENSITIVE RESIN COMPOSITION, PHOTOSENSITIVE ELEMENT, CURED PRODUCT, SEMICONDUCTOR DEVICE, METHOD FOR FORMING RESIST PATTERN, AND METHOD FOR PRODUCING CIRCUIT SUBSTRATE | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2017-11-16 | — | — | US | disclosed |
| EP-0705250-A1 | BIS-IMIDE POLYCYCLIC AND HETEROCYCLIC CHROMOPHORES USEFUL AS TUMORICIDALS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1996-04-10 | — | — | EP | disclosed |