Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | FDPS | P14324 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6912524 | 1.00 | ALDH1A1 (0.50) | ALDH1A1MTNR1AMTNR1BMAPK1FFAR1 | |
| SCHEMBL6914649 | 1.00 | ALDH1A1 (0.50) | ALDH1A1MTNR1AMTNR1BMAPK1FFAR1 | |
| SCHEMBL6915551 | 0.83 | FFAR1 (0.48) | ALDH1A1MTNR1AMTNR1BMAPK1FFAR1 | |
| SCHEMBL9125570 | 0.82 | CA2 (0.57) | ALDH1A1MTNR1AMTNR1BMAPK1FFAR1 | |
| SCHEMBL5411923 | 0.81 | ALDH1A1 (0.54) | ALDH1A1MTNR1AMTNR1BMAPK1FFAR1 | |
| SCHEMBL27671343 | 0.80 | ALDH1A1 (0.49) | ALDH1A1MTNR1AMTNR1BMAPK1FFAR1 | |
| SCHEMBL769845 | 0.78 | ALDH1A1 (0.61) | ALDH1A1MTNR1AMTNR1BMAPK1FFAR1 | |
| SCHEMBL6355322 | 0.77 | CA2 (0.47) | ALDH1A1MTNR1AMTNR1BMAPK1CYP1A2 | |
| SCHEMBL6906539 | 0.75 | ALDH1A1 (0.47) | ALDH1A1MTNR1AMTNR1BMAPK1FFAR1 | |
| SCHEMBL6906482 | 0.75 | ALDH1A1 (0.47) | ALDH1A1MTNR1AMTNR1BMAPK1FFAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6818423-B2 | LOW-MOLECULAR-WEIGHT C4-C6-KETONES DERIVATIZED WITH REMOVABLE GROUP ARE REACTED WITH CYANIDE GROUP DONOR IN PRESENCE OF HYDROXYNITRILE LYASE OR BY RACEMIC REACTION, ACIDIC HYDROLYSIS, OPTIONALLY RESOLUTION, AND CLEAVAGE OF THE GROUP | DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO KG (AU) | 2004-11-16 | — | — | US | disclosed |
| US-20030092142-A1 | Process for the preparation of chiral alpha-hydroxycarboxylic acids | DSM FINE CHEMICALS AUSTRIA NFG GMBH & COKG (AT) | 2003-05-15 | — | — | US | disclosed |