Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RAD52 | P43351 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7308005 | 0.93 | GLA (0.39) | CYP1A2PAOXALDH1A1LMNAKDM1A | |
| SCHEMBL7313428 | 0.91 | CYP1A2 (0.37) | SMN1; SMN2CYP1A2MAPK1KDM1AHTR7 | |
| SCHEMBL7303823 | 0.89 | PAOX (0.35) | SMN1; SMN2CYP1A2PAOXTSHRRAD52 | |
| SCHEMBL7309061 | 0.88 | HSD17B10 (0.35) | SMN1; SMN2CYP1A2TSHRALDH1A1LMNA | |
| SCHEMBL7304525 | 0.87 | CYP1A2 (0.38) | SMN1; SMN2CYP1A2MAPK1ALDH1A1KDM1A | |
| SCHEMBL7307068 | 0.87 | CYP1A2 (0.38) | SMN1; SMN2CYP1A2MAPK1KDM1AMEN1 | |
| SCHEMBL7315892 | 0.87 | S1PR5 (0.36) | SMN1; SMN2CYP1A2MAPK1KDM1ACHRM2 | |
| SCHEMBL7314570 | 0.86 | CACNA1G (0.43) | SMN1; SMN2ALDH1A1KMT2AHTR7CHRM2 | |
| SCHEMBL7314586 | 0.84 | MAOB (0.37) | SMN1; SMN2CYP1A2MAPK1KDM1A | |
| SCHEMBL7314634 | 0.84 | GLA (0.38) | ALDH1A1KDM1AGLAKDM4EMEN1 |
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-0711770-A1 | Antagonists of adhesion receptors | MERCK PATENT GmbH (DE) | 1996-05-15 | — | — | EP | disclosed |