Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.40 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | TAF1 | P21675 | 1/20 | 0.40 |
| ▸ | CECR2 | Q9BXF3 | 1/20 | 0.40 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | MAP3K11 | Q16584 | 2/20 | 0.38 |
| ▸ | ITK | Q08881 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18924461 | 0.88 | MAPK14 (0.47) | MAPK14POLBNPC1RAB9ACNR2 | |
| SCHEMBL10762514 | 0.86 | RAB9A (0.52) | POLBNPC1RAB9ACNR2BRD4 | |
| SCHEMBL20897035 | 0.85 | RAB9A (0.54) | POLBNPC1RAB9ACNR2BRD4 | |
| SCHEMBL18924350 | 0.84 | FASN (0.44) | NPC1CNR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL16323327 | 0.82 | FASN (0.57) | — | |
| SCHEMBL18924393 | 0.81 | FASN (0.51) | POLBNPC1RAB9AARMAP3K11 | |
| SCHEMBL19391081 | 0.81 | ABL1 (0.45) | POLBNPC1RAB9ABRD4SLC6A2 | |
| SCHEMBL2926458 | 0.79 | POLB (0.55) | MAPK14POLBNPC1RAB9ACNR2 | |
| SCHEMBL18924529 | 0.78 | POLB (0.46) | MAPK14POLBNPC1RAB9ACNR2 | |
| SCHEMBL21634069 | 0.78 | SLC6A2 (0.47) | POLBNPC1RAB9ACNR2PDK2 |
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-9670142-B2 | 1,3-diaminocyclopentane carboxamide derivatives | MERCK PATENT GMBH (DE) | 2017-06-06 | — | — | US | disclosed |