Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 9/20 | 0.33 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7219452 | 0.72 | HTR1D (0.43) | DRD2 | |
| SCHEMBL6876168 | 0.68 | MAPK1 (0.38) | P2RX7ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL6109246 | 0.67 | HTR1D (0.38) | HTR1ADRD2 | |
| SCHEMBL6517765 | 0.67 | POLB (0.40) | HTR1ADRD2PARP1 | |
| SCHEMBL7466700 | 0.64 | HTR1A (0.48) | HTR1ADRD2P2RX7AIMP2MAPT | |
| SCHEMBL7466691 | 0.64 | HTR1A (0.48) | HTR1ADRD2P2RX7AIMP2MAPT | |
| SCHEMBL20480264 | 0.63 | CYP19A1 (0.45) | HTR1AALDH1A1LMNAMAPTKDM4E | |
| SCHEMBL32669418 | 0.62 | TTBK1 (0.40) | HTR1ADRD2ALDH1A1MEN1LMNA | |
| SCHEMBL2002050 | 0.61 | CREBBP (0.46) | CREBBPALDH1A1LMNAMAPTAHR | |
| SCHEMBL20480580 | 0.61 | MTNR1A (0.33) | P2RX7ALDH1A1MEN1KMT2AKDM4E |
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-2004101767-A2 | CBI ANALOGUES OF THE DUOCARMYCINS AND CC-1065 | THE SCRIPPS RESEARCH INSTITUTE (US) | 2004-11-25 | — | — | WO | disclosed |