Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | KIF11 | P52732 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL183037 | 0.93 | ALDH1A1 (0.56) | ALDH1A1KIF11LMNAHSD17B10NPC1 | |
| SCHEMBL469386 | 0.80 | ALDH1A1 (0.72) | ALDH1A1LMNAHSD17B10HDAC2NPC1 | |
| SCHEMBL14418354 | 0.79 | ALDH1A1 (0.73) | ALDH1A1LMNANPC1RAB9AHTT | |
| SCHEMBL223423 | 0.79 | ALDH1A1 (0.73) | ALDH1A1LMNANPC1RAB9AHTT | |
| SCHEMBL2321992 | 0.77 | ALDH1A1 (0.50) | ALDH1A1KIF11LMNANPC1CA1 | |
| SCHEMBL11179661 | 0.76 | ALDH1A1 (0.48) | ALDH1A1KIF11LMNASMN1; SMN2LIMK1 | |
| SCHEMBL5941013 | 0.76 | ALDH1A1 (0.48) | ALDH1A1LMNAHDAC2HTTSMN1; SMN2 | |
| SCHEMBL27978234 | 0.74 | HSD17B10 (0.42) | ALDH1A1KIF11LMNAHSD17B10NPC1 | |
| SCHEMBL23969869 | 0.74 | ALDH1A1 (0.64) | ALDH1A1LMNACNR1NPC1RAB9A | |
| SCHEMBL10133349 | 0.74 | MMP3 (0.48) | ALDH1A1KIF11LMNAHDAC2CA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011094890-A1 | PHENYLALANINE DERIVATIVES AND THEIR USE AS NON-PEPTIDE GLP-1 RECEPTOR MODULATORS | ARGUSINA INC. (US) | 2011-08-11 | — | — | WO | disclosed |