Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 9/20 | 0.61 |
| ▸ | CYP2A6 | P11509 | 6/20 | 0.61 |
| ▸ | TSHR | P16473 | 4/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | CASP7 | P55210 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HBB | P68871 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | NQO1 | P15559 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | AHR | P35869 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL686340 | 1.00 | CYP1A2 (0.61) | CYP1A2CYP2A6TSHRALDH1A1HSD17B10 | |
| SCHEMBL29726949 | 0.98 | CYP1A2 (0.64) | CYP1A2CYP2A6TSHRALDH1A1HSD17B10 | |
| SCHEMBL460085 | 0.98 | CYP1A2 (0.64) | CYP1A2CYP2A6TSHRALDH1A1HSD17B10 | |
| SCHEMBL28539710 | 0.96 | CYP1A2 (0.61) | CYP1A2CYP2A6TSHRALDH1A1HSD17B10 | |
| Boric Acid SCHEMBL28184389 | 0.90 | CYP1A2 (0.55) | CYP1A2CYP2A6TSHRALDH1A1HSD17B10 | |
| SCHEMBL15412757 | 0.86 | CYP1A2 (0.56) | CYP1A2CYP2A6TSHRALDH1A1HSD17B10 | |
| SCHEMBL29060624 | 0.85 | CYP1A2 (0.50) | CYP1A2CYP2A6TSHRALDH1A1HSD17B10 | |
| SCHEMBL28412917 | 0.85 | CYP1A2 (0.59) | CYP1A2CYP2A6TSHRALDH1A1HSD17B10 | |
| Fluorene SCHEMBL28279465 | 0.84 | CYP1A2 (0.48) | CYP1A2CYP2A6TSHRALDH1A1HSD17B10 | |
| SCHEMBL164132 | 0.83 | CYP1A2 (0.52) | CYP1A2CYP2A6TSHRALDH1A1HSD17B10 |
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-5153321-A | Tetrathionaphthalene, tetraselenonaphthalene, tetratelluro-naphthalene, tetrathiotetracene, tetraselenotetracene, or tetratellurotetracene compounds for charge-transfer complexes | CIBA-GEIGY CORPORATION (US) | 1992-10-06 | — | — | US | disclosed |
| US-5009812-A | Forming charge transfer complexes | CIBA-GEIGY CORPORATION (US) | 1991-04-23 | — | — | US | disclosed |
| CN-88101671-A | Antistatic and conduct electricity polymkeric substance and moulding material | — | 1988-10-19 | — | — | CN | disclosed |