Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 1/20 | 0.47 |
| ▸ | CCR1 | P32246 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CCR5 | P51681 | 1/20 | 0.45 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.42 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | GLO1 | Q04760 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5884609 | 0.80 | MCHR1 (0.57) | MCHR1 | |
| SCHEMBL22288175 | 0.76 | ALDH1A1 (0.49) | METAP2CCR1CCR5PDK2PARP1 | |
| SCHEMBL7993066 | 0.75 | METAP2 (0.49) | METAP2CCR1RAB9ACCR5PARP1 | |
| SCHEMBL13740154 | 0.72 | CCR1 (0.48) | METAP2CCR1RAB9ACCR5PDK2 | |
| SCHEMBL31240954 | 0.72 | HTR2C (0.52) | — | |
| SCHEMBL31173132 | 0.71 | LRRK2 (0.38) | RAB9APDK2PDK4KDM4EPOLB | |
| SCHEMBL13739471 | 0.70 | CCR1 (0.45) | METAP2CCR1RAB9ACCR5PDK2 | |
| SCHEMBL8056158 | 0.69 | DRD2 (0.50) | CCR1KDM4EALDH1A1LMNAHPGD | |
| SCHEMBL8181776 | 0.69 | CCR1 (0.48) | METAP2CCR1RAB9ACCR5PDK2 | |
| SCHEMBL7648672 | 0.69 | CYP2A6 (0.47) | RAB9AKDM4EALDH1A1HPGDHSD17B10 |
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-2023134776-A1 | IRON-CATALYZED HIGHLY ENANTIOSELECTIVE CIS-DIHYDROXYLATION OF QUINONES | VERSITECH LIMITED (CN) | 2023-07-20 | — | — | WO | disclosed |