Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCOA1 | Q15788 | 1/20 | 0.42 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | AGXT | P21549 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11250659 | 0.83 | NCOA1 (0.46) | NCOA1NCOA3CYP2A6LMNAALDH1A1 | |
| SCHEMBL674709 | 0.82 | MAPK1 (0.47) | NCOA1NCOA3CYP2A6LMNAKDM4E | |
| SCHEMBL9172219 | 0.82 | GPR84 (0.42) | CYP1A2CYP2A6KDM4EMEN1KMT2A | |
| SCHEMBL3960261 | 0.80 | CYP2A6 (0.56) | GAARCE1CYP1A2CYP2A6MAPT | |
| SCHEMBL9418893 | 0.80 | LMNA (0.47) | NCOA1NCOA3GAACYP1A2LMNA | |
| SCHEMBL8487339 | 0.77 | TNF (0.41) | NCOA1NCOA3GAACYP1A2MAPT | |
| SCHEMBL13839608 | 0.76 | ALDH1A1 (0.43) | GAARCE1CYP1A2CYP2A6LMNA | |
| SCHEMBL9173028 | 0.76 | GPR84 (0.35) | CYP1A2CYP2A6MAPTKDM4EMEN1 | |
| SCHEMBL9175140 | 0.75 | GPR84 (0.54) | LMNAMAPTKDM4EMEN1KMT2A | |
| SCHEMBL13839484 | 0.74 | KMT2A (0.42) | NCOA1NCOA3GAARCE1CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5962744-A | USING CATALYST COMPLEX CONTAINING TRANSITION METAL AND PHOSPHITE LIGAND | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1999-10-05 | — | — | US | claimed |
| US-5962744-A | USING CATALYST COMPLEX CONTAINING TRANSITION METAL AND PHOSPHITE LIGAND | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1999-10-05 | — | — | US | disclosed |