Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KDM6B | O15054 | 1/20 | 0.35 |
| ▸ | KDM4A | O75164 | 1/20 | 0.35 |
| ▸ | KDM5C | P41229 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.35 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.35 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL885496 | 0.91 | SIGMAR1 (0.39) | HTR2ATMEM97SIGMAR1DRD2DRD4 | |
| SCHEMBL2062636 | 0.88 | BTK (0.44) | BTKMEN1KMT2A | |
| SCHEMBL885863 | 0.86 | MAPK1 (0.44) | DRD2DRD4DRD3MAPK1ALDH1A1 | |
| SCHEMBL885569 | 0.85 | JAK2 (0.42) | HTR2ATMEM97SIGMAR1DRD2DRD4 | |
| SCHEMBL2063261 | 0.79 | CA1 (0.43) | DRD2DRD4DRD3ALDH1A1CYP3A4 | |
| SCHEMBL2063262 | 0.79 | CA1 (0.43) | DRD2DRD4DRD3ALDH1A1CYP3A4 | |
| SCHEMBL885518 | 0.77 | GHSR (0.39) | DRD2DRD4DRD3MAPK1ALDH1A1 | |
| SCHEMBL885576 | 0.77 | GHSR (0.39) | DRD2DRD4DRD3MAPK1ALDH1A1 | |
| SCHEMBL2063126 | 0.77 | MEN1 (0.46) | MAPK1BTKMEN1KMT2A | |
| SCHEMBL885480 | 0.77 | JAK2 (0.41) | HTR2ATMEM97SIGMAR1DRD2DRD4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008089005-A2 | RENIN INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-07-24 | — | — | WO | disclosed |