Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5195710 | 0.89 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2POLBEPHX2CA12 | |
| SCHEMBL5193856 | 0.86 | KDM4E (0.55) | ALDH1A1POLBKDM4ECA1CA2 | |
| SCHEMBL5191195 | 0.85 | MEN1 (0.59) | ALDH1A1HPGDMAPTKDM4EHSD17B10 | |
| SCHEMBL5193954 | 0.84 | EPHX2 (0.50) | POLBEPHX2 | |
| SCHEMBL5190605 | 0.79 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2HPGDMAPTPOLB | |
| SCHEMBL5190612 | 0.78 | KMT2A (0.58) | ALDH1A1SMN1; SMN2HPGDPOLBKDM4E | |
| SCHEMBL5195925 | 0.77 | KMT2A (0.58) | ALDH1A1HPGDPOLBKDM4E | |
| SCHEMBL21540797 | 0.77 | HTR2C (0.57) | ALDH1A1SMN1; SMN2POLBKDM4E | |
| SCHEMBL5194022 | 0.76 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2HPGDMAPTPOLB | |
| SCHEMBL12773610 | 0.76 | SMN1; SMN2 (0.75) | ALDH1A1SMN1; SMN2HPGDPOLBCA12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0968206-B8 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX INC (US) | 2007-01-24 | — | — | EP | disclosed |
| EP-0968206-A1 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX LABORATORIES, INC. (US) | 2000-01-05 | — | — | EP | disclosed |
| WO-1998037079-A1 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX LABORATORIES, INC. (US) | 1998-08-27 | — | — | WO | disclosed |