Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ANPEP | P15144 | 1/20 | 0.39 |
| ▸ | ENPEP | Q07075 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NAAA | Q02083 | 1/20 | 0.37 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10951008 | 1.00 | MAPT (0.53) | MAPTCYP1A2POLBHPGDHTT | |
| SCHEMBL10846877 | 1.00 | MAPT (0.53) | MAPTCYP1A2POLBHPGDHTT | |
| SCHEMBL7511417 | 0.95 | MAPT (0.47) | MAPTCYP1A2POLBHPGDHTT | |
| SCHEMBL11200347 | 0.95 | MAPT (0.47) | MAPTCYP1A2POLBHPGDHTT | |
| SCHEMBL9897733 | 0.95 | MAPT (0.47) | MAPTCYP1A2POLBHPGDHTT | |
| SCHEMBL9897732 | 0.95 | MAPT (0.47) | MAPTCYP1A2POLBHPGDHTT | |
| SCHEMBL17592570 | 0.94 | MAPT (0.57) | MAPTCYP1A2POLBHPGDHTT | |
| SCHEMBL9406956 | 0.94 | MAPT (0.57) | MAPTCYP1A2POLBHPGDHTT | |
| SCHEMBL9406949 | 0.94 | MAPT (0.57) | MAPTCYP1A2POLBHPGDHTT | |
| SCHEMBL11190251 | 0.93 | TP53 (0.47) | MAPTCYP1A2HTTTP53PKM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0087032-B1 | BICYCLOHEXYL DERIVATIVES HAVING LIQUID-CRYSTAL PROPERTIES | MERCK PATENT GmbH (DE) | 1985-05-08 | — | — | EP | disclosed |
| EP-0087032-A1 | Bicyclohexyl derivatives having liquid-crystal properties | MERCK PATENT GmbH (DE) | 1983-08-31 | — | — | EP | disclosed |