Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | F2 | P00734 | 1/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | HPGDS | O60760 | 2/20 | 0.47 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8611942 | 0.91 | HPGDS (0.58) | ALDH1A1HPGDF2GLAHPGDS | |
| SCHEMBL7466188 | 0.85 | PARP1 (0.56) | ALDH1A1HPGDSPDE10AKMT2AKDM4E | |
| SCHEMBL27765371 | 0.81 | ALDH1A1 (0.48) | ALDH1A1HPGDF2GLALMNA | |
| SCHEMBL7594203 | 0.80 | PARP1 (0.45) | ALDH1A1HPGDHPGDSPDE10AKMT2A | |
| SCHEMBL7597610 | 0.78 | PARP1 (0.43) | ALDH1A1HPGDHPGDSPDE10AKMT2A | |
| SCHEMBL250301 | 0.78 | LMNA (0.65) | ALDH1A1KMT2AKDM4EL3MBTL1TDP1 | |
| Trimethylammonium SCHEMBL7594552 | 0.77 | PARP1 (0.42) | ALDH1A1HPGDSPDE10AKMT2AKDM4E | |
| Bromide SCHEMBL7460540 | 0.77 | PARP1 (0.42) | ALDH1A1HPGDHPGDSPDE10AKMT2A | |
| SCHEMBL28012242 | 0.77 | KDM4E (0.44) | ALDH1A1HPGDHPGDSPDE10AKMT2A | |
| SCHEMBL8570162 | 0.76 | ALDH1A1 (0.68) | ALDH1A1HPGDF2GLAKMT2A |
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-5824689-A | 3,8-DIHYROXYQUINOLINE AND DERIVATIVES, ANTICANCER AGENT, PREPARATION FROM 8-ALKOXYQUINOLINE-3-CARBOXAMIDE, HOFFMAN REARRANGEMENT, DIAZOTIZATION | SAMSUNG GENERAL CHEMICALS CO., LTD. (KR) | 1998-10-20 | — | — | US | claimed |
| US-5824689-A | 3,8-DIHYROXYQUINOLINE AND DERIVATIVES, ANTICANCER AGENT, PREPARATION FROM 8-ALKOXYQUINOLINE-3-CARBOXAMIDE, HOFFMAN REARRANGEMENT, DIAZOTIZATION | SAMSUNG GENERAL CHEMICALS CO., LTD. (KR) | 1998-10-20 | — | — | US | disclosed |