Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.77 |
| ▸ | CA1 | P00915 | 1/20 | 0.66 |
| ▸ | CA2 | P00918 | 1/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.55 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.55 |
| ▸ | RXRA | P19793 | 2/20 | 0.54 |
| ▸ | RXRB | P28702 | 1/20 | 0.54 |
| ▸ | RXRG | P48443 | 1/20 | 0.54 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.53 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.51 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.51 |
| ▸ | XDH | P47989 | 1/20 | 0.51 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.50 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1877592 | 0.88 | CA1 (0.63) | KDM4ECA1CA2ALDH1A1RXRA | |
| SCHEMBL9781486 | 0.87 | KDM4E (0.67) | KDM4ECA1CA2PARP10PARP15 | |
| SCHEMBL34463427 | 0.87 | KDM4E (1.00) | KDM4ECA1CA2ALDH1A1CYP1A2 | |
| SCHEMBL8132 | 0.87 | KDM4E (1.00) | KDM4ECA1CA2ALDH1A1CYP1A2 | |
| SCHEMBL2511835 | 0.87 | CA1 (0.87) | KDM4ECA1CA2HPGDPARP10 | |
| Hydrochloric Acid SCHEMBL3541422 | 0.85 | KDM4E (0.96) | KDM4ECA1CA2ALDH1A1CYP1A2 | |
| SCHEMBL28600429 | 0.85 | CA1 (0.70) | KDM4ECA1CA2ALDH1A1CYP1A2 | |
| SCHEMBL5875335 | 0.85 | KDM4E (0.96) | KDM4ECA1CA2ALDH1A1CYP1A2 | |
| SCHEMBL8080613 | 0.85 | KDM4E (0.69) | KDM4EALDH1A1HPGDPARP10PARP15 | |
| SCHEMBL9618429 | 0.85 | KDM4E (0.70) | KDM4EALDH1A1AKR1C3NPC1POLB |
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-5169978-A | Polyester monomer | SOCIETE ATOCHEM (FR) | 1992-12-08 | — | — | US | disclosed |
| US-5140018-A | Fungicides | ABBOTT LABORATORIES (US) | 1992-08-18 | — | — | US | disclosed |