Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.61 |
| ▸ | SLC40A1 | Q9NP59 | 5/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.50 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.50 |
| ▸ | TOP1 | P11387 | 1/20 | 0.49 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL28912996 | 0.84 | LMNA (0.50) | DHODHSLC40A1ALOX15HTTGLO1 | |
| SCHEMBL30462472 | 0.84 | LMNA (0.50) | DHODHSLC40A1ALOX15HTTGLO1 | |
| SCHEMBL12990378 | 0.81 | KEAP1 (0.67) | SLC40A1GLO1MT-CO2LMNAMEN1 | |
| SCHEMBL28560347 | 0.80 | PTGS2 (0.57) | TOP1MT-CO2LMNAKDM4EMEN1 | |
| SCHEMBL27863537 | 0.77 | GLO1 (0.62) | ALOX15HTTGLO1KMT2APTGS1 | |
| SCHEMBL11557054 | 0.77 | KMT2A (0.60) | DHODHSLC40A1HTTTOP1MT-CO2 | |
| SCHEMBL11558727 | 0.77 | DHODH (0.63) | DHODHSLC40A1TOP1MT-CO2LMNA | |
| SCHEMBL10834747 | 0.77 | DHODH (0.62) | DHODHSLC40A1TOP1MT-CO2LMNA | |
| SCHEMBL11016002 | 0.77 | DHODH (0.62) | DHODHSLC40A1TOP1MT-CO2LMNA | |
| SCHEMBL11011871 | 0.76 | DHODH (0.81) | DHODHHTTTOP1MT-CO2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-112745237-B | 2-arylamine compound and preparation method and application thereof | 中国科学院上海药物研究所 | 2023-06-20 | — | — | CN | disclosed |
| CN-112745237-A | 2-arylamine compound and preparation method and application thereof | 中国科学院上海药物研究所 | 2021-05-04 | — | — | CN | disclosed |