Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.67 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | CASP1 | P29466 | 2/20 | 0.48 |
| ▸ | CASP7 | P55210 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | XDH | P47989 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.47 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.47 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL22912827 | 0.83 | CA1 (0.50) | ALDH1A1KMT2AKDM4EHSD17B10HPGD | |
| SCHEMBL27804334 | 0.81 | ALDH1A1 (0.64) | ALDH1A1HDAC1KMT2AKDM4EHSD17B10 | |
| SCHEMBL9436316 | 0.81 | ALDH1A1 (0.69) | ALDH1A1HDAC1KMT2AHPGDCYP2C9 | |
| SCHEMBL4218090 | 0.81 | ALDH1A1 (0.64) | ALDH1A1HDAC1KMT2AKDM4EHSD17B10 | |
| SCHEMBL8350323 | 0.81 | ALDH1A1 (0.69) | ALDH1A1HDAC1KMT2AKDM4EHSD17B10 | |
| SCHEMBL13088436 | 0.81 | KDM4E (0.69) | ALDH1A1KMT2AKDM4EHSD17B10HPGD | |
| SCHEMBL7420862 | 0.81 | ALDH1A1 (0.69) | ALDH1A1HDAC1KMT2AKDM4EHSD17B10 | |
| SCHEMBL30487008 | 0.81 | KDM4E (0.69) | ALDH1A1KMT2AKDM4EHSD17B10HPGD | |
| SCHEMBL18737953 | 0.80 | ALDH1A1 (0.67) | ALDH1A1HDAC1KMT2AKDM4EHSD17B10 | |
| SCHEMBL15693330 | 0.80 | ALDH1A1 (0.62) | ALDH1A1HDAC1KMT2AKDM4EHPGD |
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-6228868-B1 | ANTICARCINOGENIC AND ANTITUMOR AGENTS | ABBOTT LABORATORIES | 2001-05-08 | — | — | US | disclosed |
| WO-2000006556-A1 | SUBSTITUTED OXAZOLINES AS ANTIPROLIFERATIVE AGENTS | ABBOTT LABORATORIES (US) | 2000-02-10 | — | — | WO | disclosed |