Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HPRT1 | P00492 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
| ▸ | WDR5 | P61964 | 1/20 | 0.40 |
| ▸ | METAP2 | P50579 | 1/20 | 0.39 |
| ▸ | LDHA | P00338 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3367134 | 0.82 | HSD17B10 (0.59) | ALDH1A1MEN1KMT2AHSD17B10KDM4E | |
| SCHEMBL31429106 | 0.82 | HSD17B10 (0.59) | ALDH1A1MEN1KMT2AHSD17B10KDM4E | |
| SCHEMBL4960184 | 0.79 | NCEH1 (0.42) | ALDH1A1MEN1KMT2AHSD17B10KDM4E | |
| SCHEMBL29819980 | 0.78 | WDR5 (0.50) | ALDH1A1ALOX15MEN1KMT2AHSD17B10 | |
| SCHEMBL6609007 | 0.78 | ALDH1A1 (0.54) | ALDH1A1MEN1KMT2AHSD17B10KDM4E | |
| SCHEMBL3918323 | 0.78 | ABCG2 (0.54) | ALDH1A1ALOX15MEN1KMT2AHSD17B10 | |
| SCHEMBL608187 | 0.78 | WDR5 (0.50) | ALDH1A1ALOX15MEN1KMT2AHSD17B10 | |
| SCHEMBL7658707 | 0.77 | ALDH1A1 (0.42) | ALDH1A1MEN1KMT2AHSD17B10KDM4E | |
| SCHEMBL15829530 | 0.77 | ALDH1A1 (0.42) | ALDH1A1MEN1KMT2AHSD17B10KDM4E | |
| SCHEMBL9762785 | 0.77 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2AHSD17B10KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1915386-B1 | METAL COMPLEX | MERCK PATENT GMBH (DE) | 2011-06-08 | — | — | EP | disclosed |
| EP-1915386-A1 | METAL COMPLEX | Merck Patent GmbH (DE) | 2008-04-30 | — | — | EP | disclosed |
| WO-2007019942-A1 | METAL COMPLEX | MERCK PATENT GMBH (DE) | 2007-02-22 | — | — | WO | disclosed |