Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 6/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29727839 | 0.85 | TDP1 (0.56) | CYP1A2TDP1TSHRSMN1; SMN2CYP3A4 | |
| SCHEMBL27683829 | 0.85 | TDP1 (0.56) | CYP1A2TDP1TSHRSMN1; SMN2CYP3A4 | |
| SCHEMBL9575258 | 0.83 | CYP1A2 (0.50) | CYP1A2TDP1TSHRSMN1; SMN2CYP3A4 | |
| SCHEMBL61678 | 0.83 | CYP1A2 (0.60) | CYP1A2TDP1TSHRSMN1; SMN2CYP3A4 | |
| SCHEMBL11394486 | 0.82 | TDP1 (0.52) | CYP1A2TDP1TSHRSMN1; SMN2CYP3A4 | |
| SCHEMBL11034572 | 0.80 | TDP1 (0.50) | CYP1A2TDP1TSHRSMN1; SMN2CYP3A4 | |
| SCHEMBL1993159 | 0.80 | CYP1A2 (0.52) | CYP1A2TDP1TSHRSMN1; SMN2CYP3A4 | |
| SCHEMBL22833410 | 0.80 | CYP1A2 (0.52) | CYP1A2TDP1TSHRSMN1; SMN2CYP3A4 | |
| SCHEMBL29507015 | 0.80 | CYP1A2 (0.52) | CYP1A2TDP1TSHRSMN1; SMN2CYP3A4 | |
| SCHEMBL26133898 | 0.80 | TDP1 (0.50) | CYP1A2TDP1TSHRSMN1; SMN2CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5698580-A | TREATING DISEASES CAUSED BY RESPIRATORY SYNCYTIAL VIRUS | RATIONAL DRUG DESIGN LABORATORIES (JP) | 1997-12-16 | — | — | US | disclosed |
| EP-0770609-A1 | ANTIVIRAL AGENT CONTAINING BENZODITHIIN DERIVATIVE AS ACTIVE INGREDIENT | Rational Drug Design Laboratories (JP) | 1997-05-02 | — | — | EP | disclosed |