Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.40 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 2/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7123301 | 0.83 | CYP1A2 (0.48) | ALDH1A1TSHRBRD4KDM4ETP53 | |
| SCHEMBL19608999 | 0.82 | PADI4 (0.44) | PADI4ALDH1A1TSHRTRIM24TRIM33 | |
| SCHEMBL19609000 | 0.77 | ERN1 (0.47) | PADI4KDM4EGAAERN1CA12 | |
| SCHEMBL30032733 | 0.77 | ERN1 (0.47) | PADI4KDM4EGAAERN1CA12 | |
| SCHEMBL29588097 | 0.76 | PADI4 (0.64) | PADI4ALDH1A1KDM4EERN1CYP1A2 | |
| SCHEMBL986883 | 0.76 | PADI4 (0.64) | PADI4ALDH1A1KDM4EERN1CYP1A2 | |
| SCHEMBL11302952 | 0.75 | PADI4 (0.48) | PADI4ALDH1A1TSHRKDM4EERN1 | |
| SCHEMBL4164444 | 0.74 | PADI4 (0.52) | PADI4ALDH1A1TSHRKDM4EHPGD | |
| SCHEMBL29802335 | 0.74 | PADI4 (0.52) | PADI4ALDH1A1TSHRKDM4EHPGD | |
| SCHEMBL3722165 | 0.74 | CYP1A2 (0.43) | ALDH1A1TSHRBRD4KDM4ETP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017193288-A1 | SYNTHESIS OF PHOSPHINE LIGANDS BEARING TUNABLE LINKAGE: METHODS OF THEIR USE IN CATALYSIS | THE HONG KONG POLYTECHNIC UNIVERSITY SHENZHEN RESEARCH INSTITUTE (CN) | 2017-11-16 | — | — | WO | disclosed |