Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 2/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MET | P08581 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL980138 | 0.90 | HCRTR1 (0.35) | MAOBALDH1A1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL980746 | 0.88 | KIF11 (0.42) | KIF11KCNH2 | |
| SCHEMBL980244 | 0.84 | MAOA (0.40) | MAOBALDH1A1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL980074 | 0.81 | MET (0.44) | ALDH1A1HPGDLMNANPSR1KDM4E | |
| SCHEMBL979241 | 0.75 | MET (0.40) | ALDH1A1RAB9AKIF11TDP1MET | |
| SCHEMBL982788 | 0.74 | MAOB (0.47) | MAOBALDH1A1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL981265 | 0.72 | KIF11 (0.45) | ALDH1A1KIF11KMT2AMET | |
| SCHEMBL1027180 | 0.72 | MAOB (0.48) | MAOBALDH1A1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL980870 | 0.71 | MAOB (0.53) | MAOBALDH1A1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL5046797 | 0.70 | MAOB (0.40) | MAOBALDH1A1HPGDRAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7875644-B2 | tyrosine kinase inhibitors, in particular Met kinase; antitumor agents;1-(Benzo-1,2,5-thiadiazol-5-ylmethylcarbonyl)-3-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazole; leukemia, carcinomas | MERCK PATENT GMBH (DE) | 2011-01-25 | — | — | US | claimed |