Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | HTR1D | P28221 | 1/20 | 0.49 |
| ▸ | HTR1B | P28222 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | MPO | P05164 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | CACNA1B | Q00975 | 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 | |
|---|---|---|---|---|
| SCHEMBL26015376 | 0.79 | SLC6A4 (0.49) | SIGMAR1HRH3SMN1; SMN2DRD2SLC6A4 | |
| SCHEMBL20204607 | 0.77 | TYR (0.41) | HTR1DALDH1A1 | |
| SCHEMBL20207840 | 0.75 | CYP2D6 (0.42) | ALDH1A1 | |
| SCHEMBL12062354 | 0.75 | HTR1D (0.42) | RECQLHTR1DALDH1A1SLC6A4MPO | |
| SCHEMBL21513937 | 0.75 | TRPV1 (0.43) | HTR1D | |
| SCHEMBL11947322 | 0.75 | SIGMAR1 (0.97) | SIGMAR1KDM4ERECQLHRH3 | |
| SCHEMBL20204830 | 0.75 | CYP2D6 (0.38) | SIGMAR1HTR1DSLC6A4SLC6A3 | |
| SCHEMBL15317676 | 0.74 | SIGMAR1 (0.66) | SIGMAR1KDM4ERECQLHRH3DRD2 | |
| SCHEMBL20204603 | 0.73 | KDM4E (0.71) | KDM4ERECQLHRH3ALDH1A1SMN1; SMN2 | |
| SCHEMBL20207510 | 0.73 | CYP2D6 (0.40) | RECQLHTR1DHTR1BALDH1A1SMN1; SMN2 |
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-2018098208-A1 | NITROGEN RING LINKED DEOXYURIDINE TRIPHOSPHATASE INHIBITORS | CV6 THERAPEUTICS (NI) LIMITED (GB) | 2018-05-31 | — | — | WO | disclosed |