Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.64 |
| ▸ | MEN1 | O00255 | 2/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29260186 | 0.84 | MEN1 (0.72) | ALDH1A1MEN1KMT2ACA12CA2 | |
| SCHEMBL14902028 | 0.84 | MEN1 (0.71) | ALDH1A1MEN1KMT2ACA12CA9 | |
| SCHEMBL29244281 | 0.80 | ALDH1A1 (0.57) | ALDH1A1MEN1KMT2ATSHRHPGD | |
| SCHEMBL5567042 | 0.79 | ALDH1A1 (0.75) | ALDH1A1MEN1KMT2ACA12CA2 | |
| SCHEMBL17974011 | 0.78 | ALDH1A1 (1.00) | ALDH1A1MEN1KMT2ACA12CA2 | |
| SCHEMBL8213969 | 0.77 | ALDH1A1 (0.72) | ALDH1A1MEN1KMT2ACA12CA2 | |
| SCHEMBL14751071 | 0.77 | ALDH1A1 (0.71) | ALDH1A1MEN1KMT2ACA12CA9 | |
| SCHEMBL30822628 | 0.77 | ALDH1A1 (0.71) | ALDH1A1MEN1KMT2ACA12CA9 | |
| SCHEMBL1504601 | 0.76 | ALDH1A1 (0.66) | ALDH1A1MEN1KMT2ACA12CA2 | |
| SCHEMBL9665638 | 0.76 | ALDH1A1 (0.86) | ALDH1A1MEN1KMT2ACA12CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20160222423-A1 | ENZYME-CATALYZED ENANTIOSELECTIVE AZIRIDINATION OF OLEFINS | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2016-08-04 | — | — | US | disclosed |