Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | PPARG | P37231 | 3/20 | 0.44 |
| ▸ | PPARA | Q07869 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8438371 | 0.89 | CYP1A2 (0.52) | CYP2A6TDP1CYP1A2PPARGPPARA | |
| SCHEMBL11579124 | 0.87 | TDP1 (0.54) | CYP2A6TDP1CYP1A2PPARGPPARA | |
| SCHEMBL9770329 | 0.82 | CYP2A6 (0.54) | CYP2A6TDP1CYP1A2PPARGPPARA | |
| SCHEMBL3395724 | 0.82 | MEN1 (0.46) | CYP1A2PPARGPPARASMN1; SMN2LMNA | |
| SCHEMBL1162019 | 0.82 | ACHE (0.50) | TDP1PPARGPPARAPOLBMAPT | |
| SCHEMBL21137383 | 0.80 | NQO2 (0.45) | CYP2A6CYP1A2PPARGPPARASMN1; SMN2 | |
| SCHEMBL5291190 | 0.79 | ACHE (0.50) | TDP1POLBSMN1; SMN2LMNAMEN1 | |
| SCHEMBL11578952 | 0.79 | CYP2A6 (0.46) | CYP2A6TDP1CYP1A2PPARGPPARA | |
| SCHEMBL276584 | 0.78 | CYP1A2 (0.58) | CYP2A6TDP1CYP1A2PPARGPPARA | |
| SCHEMBL8675364 | 0.78 | PPARG (0.51) | CYP2A6TDP1CYP1A2PPARGPPARA |
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 |
|---|---|---|---|---|---|---|---|
| US-5888929-A | HEAT SENSITIVE RECORDING SHEET, ADHESIVE AND DECOLORING AGENT | OJI PAPER CO., LTD. (JP) | 1999-03-30 | — | — | US | disclosed |