Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | RET | P07949 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL474661 | 0.79 | KMT2A (0.70) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL9913293 | 0.78 | NAPRT (0.59) | ALDH1A1SMN1; SMN2MEN1KMT2AHPGD | |
| SCHEMBL9771269 | 0.78 | KMT2A (0.68) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL13382246 | 0.77 | ENPP2 (0.46) | HPGDHDAC1HDAC8HDAC6CA1 | |
| SCHEMBL4611638 | 0.75 | CA12 (0.53) | SMN1; SMN2MEN1KMT2ACYP2C19RAB9A | |
| SCHEMBL256233 | 0.73 | ACACB (0.55) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL4748577 | 0.72 | CYP2C9 (0.56) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL254714 | 0.71 | PTPN11 (0.51) | CA12CA1CA9NAMPT | |
| SCHEMBL17792928 | 0.70 | RXFP1 (0.57) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL8319331 | 0.70 | CYP2C9 (0.50) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1795545-A1 | NOVEL POLYACETYLENE DERIVATIVES | Japan Science and Technology Agency (JP) | 2007-06-13 | — | — | EP | disclosed |