Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 3/20 | 0.42 |
| ▸ | MMP9 | P14780 | 3/20 | 0.42 |
| ▸ | MMP8 | P22894 | 3/20 | 0.42 |
| ▸ | MMP13 | P45452 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL24332207 | 0.85 | HPGD (0.49) | HPGDFAAHMEN1KMT2ANPC1 | |
| SCHEMBL1370385 | 0.85 | HPGD (0.49) | HPGDFAAHMEN1KMT2ANPC1 | |
| SCHEMBL1370386 | 0.85 | HPGD (0.49) | HPGDFAAHMEN1KMT2ANPC1 | |
| SCHEMBL9329177 | 0.79 | HPGD (0.50) | HPGDFAAHNPC1RAB9ACA12 | |
| SCHEMBL841889 | 0.79 | HPGD (0.43) | HPGDFAAHMEN1KMT2ANPC1 | |
| SCHEMBL841890 | 0.79 | HPGD (0.43) | HPGDFAAHMEN1KMT2ANPC1 | |
| SCHEMBL5274618 | 0.79 | MMP9 (0.52) | HPGDMMP2MMP9MMP8MMP13 | |
| SCHEMBL5274624 | 0.79 | MMP9 (0.52) | HPGDMMP2MMP9MMP8MMP13 | |
| SCHEMBL532254 | 0.78 | MEN1 (0.50) | HPGDFAAHMEN1KMT2ANPC1 | |
| SCHEMBL17046807 | 0.78 | MEN1 (0.50) | HPGDFAAHMEN1KMT2ANPC1 |
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-0387605-B1 | Process for the stereoselective preparation of optically active S,S or R,R-beta-aminoalcohols | BAYER AG (DE) | 1994-03-30 | — | — | EP | disclosed |
| EP-0387605-A2 | Process for the stereoselective preparation of optically active S,S or R,R-beta-aminoalcohols | BAYER AG (DE) | 1990-09-19 | — | — | EP | disclosed |