Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | CRHBP | P24387 | 2/20 | 0.48 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | RAC1 | P63000 | 1/20 | 0.46 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.41 |
| ▸ | CCR4 | P51679 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3392823 | 0.89 | MAPT (0.47) | CRHBPCRHR2HTTMAPTRAC1 | |
| SCHEMBL3391848 | 0.81 | ALDH1A1 (0.55) | PKMMAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL14818929 | 0.71 | KMT2A (0.64) | TSHRCRHBPCRHR2PKMPIK3CB | |
| SCHEMBL961117 | 0.70 | CRHBP (0.65) | TSHRCRHBPCRHR2PKMPIK3CB | |
| SCHEMBL3392632 | 0.69 | RAC1 (0.58) | MAPTRAC1KCNH3CCR4CACNA2D1 | |
| SCHEMBL16094930 | 0.67 | RAF1 (0.59) | TSHRCRHBPCRHR2PKMPIK3CB | |
| SCHEMBL16094633 | 0.67 | RAF1 (0.59) | TSHRCRHBPCRHR2PKMPIK3CB | |
| SCHEMBL16094631 | 0.67 | RAF1 (0.59) | TSHRCRHBPCRHR2PKMPIK3CB | |
| SCHEMBL3388177 | 0.67 | RAC1 (0.51) | MAPTRAC1KCNH3CCR4CACNA2D1 | |
| SCHEMBL13119675 | 0.66 | KMT2A (0.64) | TSHRCRHBPCRHR2PKMPIK3CB |
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-2241555-A1 | New RAC1 inhibitors as potential pharmacological agents for heart failure treatment | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2010-10-20 | — | — | EP | claimed |
| EP-2241555-A1 | New RAC1 inhibitors as potential pharmacological agents for heart failure treatment | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2010-10-20 | — | — | EP | disclosed |