Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 5/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | MPL | P40238 | 2/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1010355 | 0.76 | ALDH1A1 (0.40) | METAP1TAAR1GRM5GRM1HTR2C | |
| SCHEMBL3122879 | 0.66 | NOTUM (0.36) | METAP1TAAR1GRM5GRM1HTR2C | |
| SCHEMBL1508269 | 0.65 | NOTUM (0.44) | METAP1GRM5GRM1CES1HTR2C | |
| SCHEMBL29634317 | 0.65 | NOTUM (0.44) | METAP1GRM5GRM1CES1HTR2C | |
| SCHEMBL28010286 | 0.64 | CES1 (0.41) | METAP1CES1HTR2CNOTUMHSD11B1 | |
| SCHEMBL1508383 | 0.62 | CYP2A6 (0.44) | METAP1GRM5GRM1CES1HTR2C | |
| SCHEMBL17103975 | 0.62 | NOTUM (0.36) | METAP1TAAR1HTR2CHTR2BNOTUM | |
| SCHEMBL30218845 | 0.62 | NOTUM (0.36) | METAP1TAAR1HTR2CHTR2BNOTUM | |
| SCHEMBL33531892 | 0.61 | PARP10 (0.40) | GRM5GRM1ALDH1A1KDM4ENOS3 | |
| SCHEMBL2796047 | 0.60 | NOS3 (0.47) | CES1HTR2CNOTUMHSD11B1ALDH1A1 |
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-2054416-B1 | SUBSTITUTED PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE | MERZ PHARMA GMBH & CO KGAA (DE) | 2011-01-05 | — | — | EP | disclosed |
| EP-2090576-A1 | 6-halo-pyrazolo[1,5-a]pyridines, a process for their preparation and their use as metabotropic glutamate receptor (mGluR) modulators | Merz Pharma GmbH & Co.KGaA (DE) | 2009-08-19 | — | — | EP | disclosed |