Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL15824536 | 1.00 | ACE2 (0.42) | ACE2PTPN1TSHRBLMMAPT | |
| SCHEMBL15824535 | 1.00 | ACE2 (0.42) | ACE2PTPN1TSHRBLMMAPT | |
| SCHEMBL1783660 | 0.98 | ACE2 (0.44) | ACE2PTPN1TSHRBLMMAPT | |
| SCHEMBL14681977 | 0.98 | ACE2 (0.44) | ACE2PTPN1TSHRBLMMAPT | |
| SCHEMBL31508909 | 0.94 | ACE2 (0.50) | ACE2PTPN1TSHRMAPTALDH1A1 | |
| SCHEMBL10480694 | 0.94 | ACE2 (0.50) | ACE2PTPN1TSHRMAPTALDH1A1 | |
| SCHEMBL1781703 | 0.91 | ACE2 (0.47) | ACE2TSHRBLMMAPTALDH1A1 | |
| SCHEMBL15368117 | 0.89 | ACE2 (0.50) | ACE2TSHRMAPTALDH1A1LMNA | |
| SCHEMBL10480678 | 0.89 | ACE2 (0.50) | ACE2TSHRMAPTALDH1A1LMNA | |
| SCHEMBL7999104 | 0.89 | ACE2 (0.50) | ACE2TSHRMAPTALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1828159-B1 | ASYMMETRIC HYDROGENATION OF ALKENES USING CHIRAL IRIDIUM COMPLEXES | DSM IP ASSETS BV (NL) | 2011-08-17 | — | — | EP | claimed |