Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | POLA1 | P09884 | 1/20 | 0.51 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.48 |
| ▸ | RAD52 | P43351 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | BRAF | P15056 | 1/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12614443 | 0.86 | RAPGEF4 (0.59) | CYP3A4MAPTHTTPOLA1RAPGEF4 | |
| SCHEMBL6076594 | 0.82 | EPHX1 (0.57) | MAPTHTTPOLA1RAPGEF4GAA | |
| SCHEMBL11447609 | 0.82 | GAA (0.65) | CYP3A4TSHRMAPTALDH1A1HTT | |
| SCHEMBL331059 | 0.80 | ALDH1A1 (0.59) | CYP3A4TSHRMAPTALDH1A1HTT | |
| SCHEMBL331037 | 0.78 | RAPGEF4 (0.48) | MAPTL3MBTL1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL29113772 | 0.78 | HSD17B10 (0.56) | CYP3A4MAPTALDH1A1HTTPOLA1 | |
| SCHEMBL5428343 | 0.78 | MAPT (0.78) | CYP3A4TSHRMAPTALDH1A1HTT | |
| SCHEMBL29479572 | 0.78 | MAPT (0.78) | CYP3A4TSHRMAPTALDH1A1HTT | |
| SCHEMBL12747008 | 0.78 | MAPT (0.78) | CYP3A4TSHRMAPTALDH1A1HTT | |
| SCHEMBL18289620 | 0.78 | MAPT (0.78) | CYP3A4TSHRMAPTALDH1A1HTT |
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-4163015-A | ANTIBACTERIAL AGENTS | STERLING DRUG INC. (US) | 1979-07-31 | — | — | US | disclosed |
| US-4138405-A | BACTERICIDES | STERLING DRUG INC. (US) | 1979-02-06 | — | — | US | disclosed |