Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.53 |
| ▸ | CES1 | P23141 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.50 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.50 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.46 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9687402 | 0.87 | CES2 (0.50) | CES2CES1NPC1RAB9APARP1 | |
| SCHEMBL18636170 | 0.84 | NPC1 (0.56) | CES2CES1NPC1RAB9APARP1 | |
| SCHEMBL12463281 | 0.81 | NPC1 (0.53) | CES2CES1NPC1RAB9APARP1 | |
| SCHEMBL18636171 | 0.80 | NPC1 (0.51) | CES2CES1NPC1RAB9APARP1 | |
| SCHEMBL1982164 | 0.80 | CES2 (0.50) | CES2CES1NPC1RAB9APARP1 | |
| SCHEMBL16244739 | 0.79 | NPC1 (0.50) | CES2CES1NPC1RAB9APARP1 | |
| SCHEMBL2634455 | 0.79 | NPC1 (0.50) | CES2CES1NPC1RAB9APARP1 | |
| SCHEMBL2634453 | 0.79 | NPC1 (0.50) | CES2CES1NPC1RAB9APARP1 | |
| SCHEMBL3620490 | 0.78 | CES2 (0.60) | CES2CES1NPC1RAB9APARP1 | |
| SCHEMBL2154926 | 0.78 | CES2 (0.56) | CES2CES1NPC1RAB9APARP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5136114-A | PROCESS FOR THE PREPARATION OF GEMINAL DIARYLALKANES, NEW GEMINAL DIARYLALKANES AND ALK(EN)YLATED AROMATIC COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-04 | — | — | US | disclosed |