Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.49 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL5657703 | 0.84 | ALDH1A1 (0.66) | ALDH1A1HSD17B1HSD17B2MEN1KMT2A | |
| SCHEMBL13495706 | 0.77 | HSD17B1 (0.51) | ALDH1A1HSD17B1HSD17B2MEN1KMT2A | |
| SCHEMBL10789373 | 0.76 | TDP1 (0.58) | ALDH1A1MEN1KMT2AMAPTTSHR | |
| SCHEMBL13495697 | 0.75 | HSD17B1 (0.57) | ALDH1A1HSD17B1HSD17B2MEN1KMT2A | |
| SCHEMBL11639863 | 0.75 | KMT2A (0.57) | ALDH1A1MEN1KMT2APOLBMAPT | |
| SCHEMBL11210548 | 0.74 | MEN1 (0.58) | ALDH1A1HSD17B1HSD17B2MEN1KMT2A | |
| SCHEMBL13495742 | 0.72 | HSD17B1 (0.50) | ALDH1A1HSD17B1HSD17B2MEN1KMT2A | |
| SCHEMBL30622065 | 0.71 | HSD17B1 (0.75) | ALDH1A1HSD17B1HSD17B2MEN1KMT2A | |
| SCHEMBL2191052 | 0.71 | HSD17B1 (0.75) | ALDH1A1HSD17B1HSD17B2MEN1KMT2A | |
| SCHEMBL1697477 | 0.71 | KDM4E (0.49) | ALDH1A1MEN1KMT2AMAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010012745-A2 | BENZIMIDAZOLES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-02-04 | — | — | WO | disclosed |