Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | SYK | P43405 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | FOS | P01100 | 1/20 | 0.34 |
| ▸ | JUN | P05412 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15166625 | 0.80 | MAPT (0.47) | LMNAMAPTALDH1A1SYKHTT | |
| SCHEMBL16281525 | 0.76 | LMNA (0.39) | LMNACYP2C19CYP3A4CYP2D6FOS | |
| SCHEMBL16281527 | 0.73 | LMNA (0.50) | LMNAMAPTALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL5416240 | 0.71 | LMNA (0.43) | LMNAMAPTALDH1A1SYKHTT | |
| SCHEMBL14542481 | 0.70 | ALDH1A1 (0.39) | LMNAMAPTALDH1A1SYKSMN1; SMN2 | |
| SCHEMBL17863608 | 0.70 | ALDH1A1 (0.36) | LMNAMAPTALDH1A1SYKHTT | |
| SCHEMBL13812977 | 0.66 | GABBR2 (0.51) | CYP2C19CYP1A2MEN1KMT2ACYP2C9 | |
| SCHEMBL16281536 | 0.66 | LMNA (0.52) | LMNAMAPTALDH1A1CYP2D6HTT | |
| SCHEMBL15170462 | 0.66 | LMNA (0.40) | LMNAMAPTALDH1A1CYP2D6CYP1A2 | |
| SCHEMBL24494887 | 0.66 | THRB (0.40) | LMNAMAPTALDH1A1SYKPOLB |
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-2810944-A1 | HETEROCYCLIC COMPOUND HAVING ANTI-HIV ACTIVITY | Toyama Chemical Co., Ltd. (JP) | 2014-12-10 | — | — | EP | disclosed |