Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.38 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.37 |
| ▸ | CHRNG | P07510 | 1/20 | 0.37 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | CHRND | Q07001 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 2/20 | 0.35 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7083505 | 1.00 | NPC1 (0.39) | NPC1RAB9AFUCA1CHRNA1CHRNG | |
| SCHEMBL1935137 | 0.80 | CYP1A2 (0.41) | NPC1RAB9AALDH1A1 | |
| SCHEMBL10769318 | 0.80 | TDP1 (0.39) | NPC1RAB9AMAPK1CES1MEN1 | |
| SCHEMBL10871363 | 0.80 | CYP1A2 (0.41) | NPC1RAB9AALDH1A1 | |
| SCHEMBL10877634 | 0.80 | CYP1A2 (0.41) | NPC1RAB9AALDH1A1 | |
| SCHEMBL3494618 | 0.78 | LGALS3 (0.41) | NPC1RAB9ASLC29A1ALDH1A1 | |
| SCHEMBL9563961 | 0.73 | NPC1 (0.42) | NPC1RAB9ACHRNA1CHRNGCHRNB1 | |
| SCHEMBL9280727 | 0.67 | LOXL2 (0.43) | HSD17B10ACHEMAPK1MEN1KMT2A | |
| SCHEMBL30955333 | 0.67 | LGALS3 (0.41) | NPC1SLC29A1ALDH1A1 | |
| Methyl Alcohol SCHEMBL27456236 | 0.64 | HSD17B10 (0.70) | HSD17B10ACHEMAPK1CES1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0906418-A4 | — | — | 1999-05-06 | — | — | EP | disclosed |
| EP-0906418-A1 | METHODS AND COMPOSITIONS FOR CELLULAR AND METABOLIC ENGINEERING | Maxygen, Inc. (US) | 1999-04-07 | — | — | EP | disclosed |
| WO-1997035966-A1 | METHODS AND COMPOSITIONS FOR CELLULAR AND METABOLIC ENGINEERING | MAXYGEN, INC. (US) | 1997-10-02 | — | — | WO | disclosed |