Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.42 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.33 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.33 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
| ▸ | TUBB | P07437 | 1/20 | 0.33 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.33 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.33 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28804554 | 0.86 | APP (0.48) | APPKMT2AALDH1A1MAPTHPGD | |
| SCHEMBL2407370 | 0.78 | TSHR (0.39) | SLC6A3KMT2AHPGDTUBB4ATUBB | |
| SCHEMBL6927360 | 0.73 | SLC6A3 (0.48) | SLC6A3KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL14871942 | 0.70 | APP (0.46) | APPPDGFRBPDGFRATUBB4ATUBB | |
| SCHEMBL3960432 | 0.70 | APP (0.48) | APPKMT2AALDH1A1HPGDPDGFRB | |
| SCHEMBL1727532 | 0.69 | CYP2E1 (0.46) | APPKMT2AALDH1A1MAPTHPGD | |
| SCHEMBL2413548 | 0.69 | AVPR2 (0.38) | P2RX7NOTUMIDO1TSHRCYP2D6 | |
| SCHEMBL2407673 | 0.69 | CYP2A6 (0.46) | P2RX7KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL2407368 | 0.68 | HPGD (0.61) | KMT2AALDH1A1HPGDTSHR | |
| SCHEMBL440943 | 0.67 | TSHR (0.52) | NUDT1P2RX7NOTUMIDO1TSHR |
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-103189363-B | Biaryl linked aryl triazolones and uses thereof | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-07-29 | — | — | CN | disclosed |
| CN-103189363-A | Biaryl linked aryl triazolones and uses thereof | BAYER IP GMBH | 2013-07-03 | — | — | CN | disclosed |