Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MPI | P34949 | 1/20 | 0.47 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2649991 | 0.86 | LMNA (0.46) | ALDH1A1MAPTMEN1KMT2AL3MBTL1 | |
| SCHEMBL2649546 | 0.86 | HTT (0.44) | ALDH1A1NPC1MAPTRAB9AMEN1 | |
| SCHEMBL2649211 | 0.86 | RAB9A (0.43) | ALDH1A1NPC1MAPTRAB9AMEN1 | |
| SCHEMBL2651383 | 0.83 | KDM4E (0.39) | ALDH1A1MAPTKMT2AKDM4EL3MBTL1 | |
| SCHEMBL2649285 | 0.82 | RAB9A (0.48) | ALDH1A1MAPTRAB9AL3MBTL1HTT | |
| SCHEMBL2649630 | 0.78 | TDP1 (0.42) | ALDH1A1NPC1MAPTRAB9AMEN1 | |
| SCHEMBL2649878 | 0.75 | ALDH1A1 (0.45) | ALDH1A1MAPTKMT2AKDM4EHTT | |
| SCHEMBL2649623 | 0.75 | CNR2 (0.43) | POLB | |
| SCHEMBL2649291 | 0.74 | MAPT (0.50) | ALDH1A1MAPTRAB9AMEN1KMT2A | |
| SCHEMBL29812171 | 0.68 | PRKCZ (0.34) | ALDH1A1NPC1MAPTRAB9AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1064283-A1 | PYRAZOLO-PYRIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LTD. (GB) | 2001-01-03 | — | — | EP | disclosed |
| WO-1999048892-A1 | PYRAZOLO-PYRIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LIMITED (GB) | 1999-09-30 | — | — | WO | disclosed |