Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.62 |
| ▸ | PKM | P14618 | 1/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.60 |
| ▸ | CA12 | O43570 | 2/20 | 0.59 |
| ▸ | CA9 | Q16790 | 2/20 | 0.59 |
| ▸ | CA2 | P00918 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL7628596 | 0.94 | ALDH1A1 (0.70) | ALDH1A1LMNANPSR1CA12CA9 | |
| SCHEMBL812683 | 0.90 | ALDH1A1 (0.75) | ALDH1A1LMNAKDM4EPKMSMN1; SMN2 | |
| SCHEMBL6437093 | 0.90 | ALDH1A1 (0.75) | ALDH1A1LMNAKDM4EPKMSMN1; SMN2 | |
| SCHEMBL7955008 | 0.89 | ALDH1A1 (0.68) | ALDH1A1LMNAPKMCA12CA9 | |
| SCHEMBL17599857 | 0.87 | ALDH1A1 (0.66) | ALDH1A1LMNAKDM4EPKMSMN1; SMN2 | |
| SCHEMBL12849347 | 0.87 | ALDH1A1 (0.66) | ALDH1A1LMNAKDM4EPKMSMN1; SMN2 | |
| SCHEMBL812658 | 0.87 | USP2 (0.69) | ALDH1A1LMNAKDM4EPKMSMN1; SMN2 | |
| SCHEMBL8494571 | 0.86 | ALDH1A1 (0.65) | ALDH1A1LMNAPKMNPSR1CA12 | |
| Hydrochloric Acid SCHEMBL11629317 | 0.86 | ALDH1A1 (0.64) | ALDH1A1LMNAKDM4EPKMSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5093423 | 0.86 | ALDH1A1 (0.64) | ALDH1A1LMNAKDM4EPKMSMN1; SMN2 |
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-6239324-B1 | REACTING A 1,3-BUTADIENE WITH OLEFIN IN PRESENCE OF HYDROPHILIC SOLVENT AND RUTHENIUM COMPOUND | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2001-05-29 | — | — | US | disclosed |