Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARA | P10276 | 10/20 | 0.57 |
| ▸ | RARB | P10826 | 10/20 | 0.57 |
| ▸ | RARG | P13631 | 10/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.57 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.54 |
| ▸ | RXRA | P19793 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9765059 | 0.87 | RARB (0.57) | RARARARBRARGKMT2ACYP3A4 | |
| Tazarotene SCHEMBL995895 | 0.80 | RARB (0.81) | RARARARBRARGKMT2ACYP3A4 | |
| Tazarotene SCHEMBL28326300 | 0.79 | RARA (0.80) | RARARARBRARGKMT2ACYP3A4 | |
| SCHEMBL181635 | 0.76 | CYP3A4 (0.52) | RARARARBRARGKMT2ACYP3A4 | |
| SCHEMBL12371728 | 0.76 | RARB (0.78) | RARARARBRARGKMT2ACYP3A4 | |
| SCHEMBL9817871 | 0.74 | RARA (0.71) | RARARARBRARGKMT2ACYP3A4 | |
| SCHEMBL19560666 | 0.74 | RARA (0.82) | RARARARBRARGKMT2ACYP3A4 | |
| SCHEMBL16913398 | 0.74 | RARB (0.56) | RARARARBRARGKMT2ACYP3A4 | |
| SCHEMBL19034088 | 0.73 | RARB (0.62) | RARARARBRARGKMT2ACYP3A4 | |
| SCHEMBL17885756 | 0.73 | RARB (0.81) | RARARARBRARGKMT2ACYP3A4 |
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-5914334-A | A GEL FOR TOPICAL TREATMENT OF BOTH ACNE AND PSORIASIS COMPRISES ETHYL-6(2-(4,4-DIMETHYLTHIOCHROMAN-6-YL)-ETHYNYL) NICOTINATE IN A CARRIER SUCH AS: WATER, EDETATE DISODIUM, POLOXOMERS, HEXYLENE GLYCOL, TROMETHANE, POLYSORBATES ETC. | ALLERGAN, INC. (US) | 1999-06-22 | — | — | US | claimed |
| US-5824685-A | VISION DEFECTS AND GENE EXPRESSION | THE JOHNS HOPKINS UNIVERSITY SCHOOL OF MEDICINE (US) | 1998-10-20 | — | — | US | claimed |
| US-5914334-A | A GEL FOR TOPICAL TREATMENT OF BOTH ACNE AND PSORIASIS COMPRISES ETHYL-6(2-(4,4-DIMETHYLTHIOCHROMAN-6-YL)-ETHYNYL) NICOTINATE IN A CARRIER SUCH AS: WATER, EDETATE DISODIUM, POLOXOMERS, HEXYLENE GLYCOL, TROMETHANE, POLYSORBATES ETC. | ALLERGAN, INC. (US) | 1999-06-22 | — | — | US | disclosed |