Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.49 |
| ▸ | MEN1 | O00255 | 5/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | BAZ1A | Q9NRL2 | 1/20 | 0.46 |
| ▸ | DDX3X | O00571 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4865811 | 0.81 | NAMPT (0.65) | ALDH1A1SMN1; SMN2KMT2AMEN1NPC1 | |
| Hydrochloric Acid SCHEMBL4856345 | 0.77 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2KMT2AMEN1LMNA | |
| SCHEMBL4864537 | 0.77 | CYP2D6 (0.46) | ALDH1A1KMT2AMEN1LMNAMAPT | |
| SCHEMBL11144060 | 0.76 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2KMT2AMEN1NPC1 | |
| SCHEMBL13623020 | 0.75 | ALDH1A1 (0.74) | ALDH1A1SMN1; SMN2KMT2AMEN1LMNA | |
| SCHEMBL10160140 | 0.74 | ALDH1A1 (0.86) | ALDH1A1SMN1; SMN2KMT2AMEN1LMNA | |
| Hydrochloric Acid SCHEMBL1026974 | 0.74 | ALDH1A1 (0.72) | ALDH1A1SMN1; SMN2KMT2AMEN1LMNA | |
| Trifluoroacetic Acid SCHEMBL1026824 | 0.73 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2KMT2AMEN1LMNA | |
| Trifluoroacetic Acid SCHEMBL1074988 | 0.73 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2KMT2AMEN1MAPT | |
| SCHEMBL4866357 | 0.72 | MEN1 (0.67) | ALDH1A1SMN1; SMN2KMT2AMEN1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7384963-B2 | 2′-Methyl-5-(1,3,4-oxadiazol-2-yl)1, 1′-biphenyl-4-carboxaide derivatives and their use as p38 kinase | GLAXO GROUP LIMITED (GB) | 2008-06-10 | — | — | US | disclosed |