Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11135336 | 0.83 | APEX1 (0.40) | APEX1CA1CA2CA9CA12 | |
| SCHEMBL9041031 | 0.82 | RAB9A (0.43) | SLC6A4MEN1KMT2ALMNAHTR2A | |
| SCHEMBL20213933 | 0.78 | HSP90AA1 (0.47) | APEX1HSP90AA1CA1CA2CA9 | |
| SCHEMBL20213993 | 0.78 | APEX1 (0.46) | APEX1HSP90AA1CA1CA2CA9 | |
| SCHEMBL9734010 | 0.76 | VCAM1 (0.54) | ALDH1A1LMNA | |
| SCHEMBL27978393 | 0.75 | TDP1 (0.66) | APEX1CA2CA12PGRALDH1A1 | |
| SCHEMBL4348245 | 0.75 | CA2 (0.64) | APEX1CA1CA2CA9CA12 | |
| SCHEMBL10813948 | 0.75 | CA1 (0.60) | CA1CA2CA9MEN1KMT2A | |
| SCHEMBL10558186 | 0.72 | CA1 (0.47) | CA1CA2CA9CA12PGR | |
| SCHEMBL7291218 | 0.72 | CA1 (0.66) | CA1CA2CA9CA12MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4983611-A | TREATING A STOMACH MOTILITY DISTURBANCE | KALI-CHEMIE PHARMA GMBH (DE) | 1991-01-08 | — | — | US | disclosed |
| US-4906640-A | 3-sulfonyl-3,7-diazabicyclo[3,3,1]nonane compounds and medicaments containing said compounds | KALI-CHEMIE PHARMA GMBH (DE) | 1990-03-06 | — | — | US | disclosed |