Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | CTSD | P07339 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1758553 | 0.87 | CA1 (0.50) | CA1CA2HIF1ACTSDALDH1A1 | |
| SCHEMBL1047552 | 0.83 | CA2 (0.47) | CA1CA2HIF1ACTSDTDP1 | |
| SCHEMBL329299 | 0.76 | — | — | |
| Silver SCHEMBL30466745 | 0.73 | ALDH1A1 (0.39) | ALDH1A1TDP1USP2TSHRMEN1 | |
| SCHEMBL29010314 | 0.73 | ALDH1A1 (0.39) | ALDH1A1TDP1USP2TSHRMEN1 | |
| SCHEMBL31412008 | 0.73 | ALDH1A1 (0.39) | ALDH1A1TDP1USP2TSHRMEN1 | |
| SCHEMBL11375340 | 0.73 | ALDH1A1 (0.39) | ALDH1A1TDP1USP2TSHRMEN1 | |
| SCHEMBL10052282 | 0.73 | CA1 (0.52) | CA1CA2HIF1ACTSDALDH1A1 | |
| SCHEMBL13264457 | 0.73 | MEN1 (0.35) | USP2TSHRMEN1KMT2A | |
| SCHEMBL8174142 | 0.72 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0991772-A1 | METHODS AND PRECURSORS FOR THE PRODUCTION OF CHIRAL VICINAL AMINOALCOHOLS | Biocatalytics, Inc. (US) | 2000-04-12 | — | — | EP | disclosed |
| US-5942644-A | Precursors for the production of chiral vicinal aminoalcohols | BIOCATALYTICS, INC. (US) | 1999-08-24 | — | — | US | disclosed |
| WO-1998054350-A1 | METHODS AND PRECURSORS FOR THE PRODUCTION OF CHIRAL VICINAL AMINOALCOHOLS | BIOCATALYTICS, INC. (US) | 1998-12-03 | — | — | WO | disclosed |
| US-5834261-A | STEREOSPECIFIC REARRANGEMENT BIOSYNTHESIS BY MICROORGANISM | BIOCATALYTICS, INC. (US) | 1998-11-10 | — | — | US | disclosed |