Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ACACB | O00763 | 3/20 | 0.45 |
| ▸ | ALPL | P05186 | 1/20 | 0.44 |
| ▸ | ALPI | P09923 | 1/20 | 0.44 |
| ▸ | ALPG | P10696 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5322177 | 0.82 | NPC1 (0.62) | POLBNPC1RAB9APARP10GLA | |
| SCHEMBL6081274 | 0.76 | POLB (0.71) | POLBPARP10GLACYP1A2GAA | |
| SCHEMBL28168167 | 0.76 | CYP2C9 (0.59) | NPC1RAB9ACYP1A2GAACYP2C19 | |
| SCHEMBL2542923 | 0.75 | CYP1A2 (0.47) | NPC1RAB9ACYP1A2GAACYP2D6 | |
| SCHEMBL25138640 | 0.75 | ALDH1A1 (0.58) | POLBNPC1RAB9AGLACYP1A2 | |
| SCHEMBL22060073 | 0.75 | NPC1 (0.62) | POLBNPC1RAB9ANR1H4ALDH1A1 | |
| Carbamic Acid SCHEMBL28488101 | 0.75 | POLB (0.59) | POLBNPC1RAB9APARP10GLA | |
| SCHEMBL13652543 | 0.74 | NPC1 (0.61) | POLBNPC1RAB9ACYP1A2CYP2D6 | |
| SCHEMBL630790 | 0.74 | GLA (0.53) | POLBNPC1RAB9APARP10GLA | |
| SCHEMBL13190906 | 0.73 | KDM4E (0.60) | POLBNPC1RAB9APARP10GLA |
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 |
|---|---|---|---|---|---|---|---|
| CN-112119058-A | Process for the preparation of pimavanserin base | 欧伦股份公司 | 2020-12-22 | — | — | CN | disclosed |