Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | KDM1A | O60341 | 4/20 | 0.45 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.42 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6199847 | 0.87 | PTPN1 (0.63) | PTPN1ALDH1A1KDM1ABRD4L3MBTL1 | |
| SCHEMBL16096561 | 0.85 | PTPN1 (0.45) | PTPN1ALDH1A1KDM1AL3MBTL1NPC1 | |
| SCHEMBL18066381 | 0.85 | PTPN1 (0.76) | PTPN1ALDH1A1KDM1ACYP4F2CYP4A11 | |
| SCHEMBL4841962 | 0.81 | PTPN1 (0.52) | PTPN1ALDH1A1KDM1ABRD4SMN1; SMN2 | |
| SCHEMBL4846617 | 0.78 | ALDH1A1 (0.54) | PTPN1ALDH1A1KDM1ABRD4SMN1; SMN2 | |
| SCHEMBL27832255 | 0.78 | KDM1A (0.39) | PTPN1KDM1ABRD4NPC1PTGER1 | |
| SCHEMBL4840332 | 0.78 | FFAR1 (0.55) | PTPN1MRGPRX4MAOB | |
| SCHEMBL13072824 | 0.77 | CYP4F2 (0.43) | CYP4F2CYP4A11PTGS2 | |
| SCHEMBL28814038 | 0.77 | KDM1A (0.45) | PTPN1KDM1ASMN1; SMN2L3MBTL1NPC1 | |
| SCHEMBL8565737 | 0.77 | KDM1A (0.55) | KDM1ASMN1; SMN2L3MBTL1MAPTCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010134580-A1 | METHOD FOR PRODUCING AROMATIC FLUORINE COMPOUND AND NOVEL COMPOUND | 静岡県公立大学法人 (JP) | 2010-11-25 | — | — | WO | disclosed |