Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1L1 | Q9UHC9 | 3/20 | 0.62 |
| ▸ | USP2 | O75604 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | INPP5D | Q92835 | 1/20 | 0.58 |
| ▸ | SRD5A1 | P18405 | 4/20 | 0.57 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.57 |
| ▸ | FNTA | P49354 | 4/20 | 0.57 |
| ▸ | FNTB | P49356 | 4/20 | 0.57 |
| ▸ | CDC25A | P30304 | 2/20 | 0.55 |
| ▸ | POLA1 | P09884 | 1/20 | 0.55 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.54 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.53 |
| ▸ | OSBP | P22059 | 1/20 | 0.53 |
| ▸ | RORC | P51449 | 1/20 | 0.53 |
| ▸ | OSBP2 | Q969R2 | 1/20 | 0.53 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.53 |
| ▸ | ST6GAL1 | P15907 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL17817528 | 0.89 | CYP2D6 (0.60) | NPC1L1USP2LMNACYP2D6CYP2C19 | |
| SCHEMBL17817529 | 0.89 | CYP2D6 (0.60) | NPC1L1USP2LMNACYP2D6CYP2C19 | |
| SCHEMBL3123616 | 0.88 | NPC1L1 (0.59) | NPC1L1USP2LMNACYP2D6CYP2C19 | |
| SCHEMBL11327438 | 0.88 | CYP2D6 (0.59) | NPC1L1USP2LMNACYP2D6CYP2C19 | |
| SCHEMBL2436628 | 0.88 | NPC1L1 (0.59) | NPC1L1USP2LMNACYP2D6CYP2C19 | |
| SCHEMBL11296589 | 0.85 | GRIN1 (0.51) | USP2LMNAGPBAR1ST6GAL1 | |
| SCHEMBL9580414 | 0.85 | FNTA (0.54) | NPC1L1USP2LMNACYP2D6CYP2C19 | |
| SCHEMBL6391921 | 0.84 | SRD5A1 (0.69) | NPC1L1USP2LMNACYP2D6CYP2C19 | |
| SCHEMBL6391919 | 0.84 | SRD5A1 (0.69) | NPC1L1USP2LMNACYP2D6CYP2C19 | |
| SCHEMBL27545306 | 0.83 | CYP2D6 (0.65) | NPC1L1USP2LMNACYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2142920-A1 | TANDEM MASS SPECTROMETRY FOR DETECTING AND/OR SCREENING FOR CONDITIONS ASSOCIATED WITH ALTERED STEROLS | Oregon Health and Science University (US) | 2010-01-13 | — | — | EP | claimed |
| WO-2008137767-A1 | TANDEM MASS SPECTROMETRY FOR DETECTING AND/OR SCREENING FOR CONDITIONS ASSOCIATED WITH ALTERED STEROLS | OREGON HEALTH & SCIENCE UNIVERSITY (US) | 2008-11-13 | — | — | WO | claimed |