Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.47 |
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
| ▸ | RXRB | P28702 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | PLA2G1B | P04054 | 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 | |
|---|---|---|---|---|
| SCHEMBL200188 | 0.98 | BACE1 (0.49) | BACE1RXRARXRBPDE4BPTPN1 | |
| SCHEMBL14820672 | 0.91 | CYP1A2 (0.50) | BACE1PTPN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17500060 | 0.89 | ESR2 (0.47) | BACE1RXRARXRBPDE4BPTPN1 | |
| SCHEMBL14773891 | 0.88 | TSHR (0.41) | BACE1RXRARXRBPDE4BCYP1A2 | |
| SCHEMBL6320034 | 0.87 | CYP1A2 (0.53) | BACE1PTPN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL296464 | 0.86 | BACE1 (0.49) | BACE1PDE4BPTPN1CYP3A4TSHR | |
| SCHEMBL3418407 | 0.85 | CRHBP (0.48) | BACE1RXRARXRBPDE4BCYP1A2 | |
| SCHEMBL223247 | 0.84 | CYP2C19 (0.42) | BACE1PTPN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5034217 | 0.84 | CYP2C19 (0.42) | BACE1CYP1A2CYP3A4CYP2C9TSHR | |
| SCHEMBL13044392 | 0.83 | HTR7 (0.47) | BACE1PTPN1CYP1A2CYP3A4CYP2C9 |
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-5633418-A | CATALYTIC DIMERIZATION OF OLEFIN IN PRESENCE OF ORGANONICKEL, ORGANOALUMINUM AND ORGANOPHOSPHITE COMPOUNDS USED AS CATALYST | MITSUBISHI CHEMICAL CORPORATION (JP) | 1997-05-27 | — | — | US | disclosed |