Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.40 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.40 |
| ▸ | EPM2A | O95278 | 1/20 | 0.36 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | GABRP | O00591 | 4/20 | 0.36 |
| ▸ | GABRD | O14764 | 4/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19964535 | 0.83 | CYP2A6 (0.40) | CYP2A6EPM2APTPN2PTPN1PTPN22 | |
| SCHEMBL19953355 | 0.83 | MIF (0.37) | CYP2A6EPM2APTPN2PTPN1PTPN22 | |
| SCHEMBL19953390 | 0.77 | LOXL2 (0.56) | CYP2A6LOXL2ASIC3HPGD | |
| SCHEMBL19953212 | 0.76 | KAT2B (0.37) | CYP2A6EPM2APTPN2PTPN1PTPN22 | |
| SCHEMBL13978896 | 0.75 | CYP2A6 (0.58) | CYP2A6LOXL2ASIC3LMNACA2 | |
| SCHEMBL17080670 | 0.72 | CYP2A6 (0.58) | CYP2A6LOXL2ASIC3CA2 | |
| SCHEMBL29466898 | 0.70 | KDM4E (0.48) | CYP2A6EPM2APTPN2PTPN1PTPN22 | |
| SCHEMBL5019781 | 0.70 | KDM4E (0.48) | CYP2A6EPM2APTPN2PTPN1PTPN22 | |
| SCHEMBL19953250 | 0.70 | GPR35 (0.42) | CYP2A6EPM2APTPN2PTPN1PTPN22 | |
| SCHEMBL216673 | 0.69 | EPM2A (0.53) | CYP2A6EPM2APTPN2PTPN1PTPN22 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018048930-A1 | LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF | PHARMAKEA, INC. (US) | 2018-03-15 | — | — | WO | claimed |
| WO-2018048930-A1 | LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF | PHARMAKEA, INC. (US) | 2018-03-15 | — | — | WO | disclosed |
| WO-2018048930-A1 | LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF | PHARMAKEA, INC. (US) | 2018-03-15 | — | — | WO | disclosed |