Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 9/20 | 0.78 |
| ▸ | MAOA | P21397 | 9/20 | 0.66 |
| ▸ | YAP1 | P46937 | 1/20 | 0.63 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.63 |
| ▸ | PPARG | P37231 | 2/20 | 0.60 |
| ▸ | NCOA2 | Q15596 | 2/20 | 0.60 |
| ▸ | NCOA1 | Q15788 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.60 |
| ▸ | HTT | P42858 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.60 |
| ▸ | EGFR | P00533 | 1/20 | 0.58 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL1658926 | 0.81 | NT5E (0.82) | MAOBEGFR | |
| SCHEMBL2480894 | 0.80 | CA1 (0.75) | MAOBMAOAYAP1TEAD4LMNA | |
| SCHEMBL13315397 | 0.78 | NPC1 (0.65) | MAOBMAOAYAP1TEAD4 | |
| SCHEMBL16210967 | 0.78 | YAP1 (0.64) | MAOBMAOAYAP1TEAD4LMNA | |
| SCHEMBL21392773 | 0.78 | YAP1 (1.00) | MAOBMAOAYAP1TEAD4KMT2A | |
| SCHEMBL12857571 | 0.77 | YAP1 (0.74) | YAP1TEAD4HTT | |
| SCHEMBL27918010 | 0.75 | CACNA1H (0.73) | MAOBMAOAALDH1A1KDM4E | |
| SCHEMBL23052495 | 0.75 | ALDH1A1 (0.80) | MAOBMAOAPPARGNCOA2NCOA1 | |
| SCHEMBL23052313 | 0.75 | ALDH1A1 (0.80) | MAOBMAOAPPARGNCOA2NCOA1 | |
| SCHEMBL12857635 | 0.75 | HTT (0.73) | MAOBYAP1TEAD4HTTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-107266367-A | Pyrazoline analog derivative and preparation method thereof | 上海大学 | 2017-10-20 | — | — | CN | disclosed |