Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | SCD5 | Q86SK9 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5228473 | 0.96 | ALDH1A1 (0.41) | ALDH1A1KDM4ENPC1RAB9ANPSR1 | |
| SCHEMBL5224207 | 0.86 | DHODH (0.36) | POLBHRH3 | |
| SCHEMBL5229335 | 0.82 | ALDH1A1 (0.42) | ALDH1A1KDM4ENPC1RAB9ANPSR1 | |
| SCHEMBL5226166 | 0.82 | ALDH1A1 (0.41) | ALDH1A1KDM4ENPC1RAB9ANPSR1 | |
| SCHEMBL5222920 | 0.82 | ALDH1A1 (0.41) | ALDH1A1KDM4ENPC1RAB9ANPSR1 | |
| SCHEMBL5226663 | 0.82 | KMT2A (0.44) | ALDH1A1KDM4ENPC1RAB9ANPSR1 | |
| SCHEMBL5225471 | 0.81 | HRH3 (0.35) | KDM4EPOLBHRH3 | |
| SCHEMBL5226446 | 0.81 | ALDH1A1 (0.41) | ALDH1A1KDM4ENPC1RAB9ANPSR1 | |
| SCHEMBL5226838 | 0.80 | ALDH1A1 (0.41) | ALDH1A1KDM4ENPC1RAB9ANPSR1 | |
| SCHEMBL5229296 | 0.80 | HSD17B10 (0.44) | ALDH1A1KDM4ENPC1RAB9ANPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |