Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | PSD | A5PKW4 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2637343 | 0.92 | ALDH1A1 (0.46) | POLBTDP1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL2637478 | 0.89 | HSP90AA1 (0.47) | POLBTDP1PSDALDH1A1NPC1 | |
| SCHEMBL2637595 | 0.85 | MAPT (0.43) | TDP1SMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL2637889 | 0.83 | KMT2A (0.46) | POLBALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL2637590 | 0.82 | KDM4E (0.41) | ALDH1A1KDM4ECYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL2637740 | 0.80 | KDM5A (0.41) | TDP1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL2637580 | 0.80 | GRM5 (0.44) | TDP1ALDH1A1KDM4EKDRMEN1 | |
| SCHEMBL2637547 | 0.78 | NPC1 (0.48) | POLBTDP1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL2637406 | 0.77 | MAPT (0.41) | TDP1ALDH1A1KDM4ESMN1; SMN2NPC1 | |
| SCHEMBL2638047 | 0.77 | KDM4A (0.44) | POLBPSDALDH1A1KDM4ECYP2C19 |
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-2438070-A1 | GLYCINE B ANTAGONISTS | Merz Pharma GmbH & Co. KGaA (DE) | 2012-04-11 | — | — | EP | disclosed |
| WO-2010139483-A1 | GLYCINE B ANTAGONISTS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2010-12-09 | — | — | WO | disclosed |