Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 2/20 | 0.60 |
| ▸ | NQO2 | P16083 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.45 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.43 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | G6PD | P11413 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Jineol Methyl Ether SCHEMBL8613544 | 0.81 | HPGDS (0.62) | HPGDSNQO2KDM4EMCHR1PDE3B | |
| SCHEMBL434888 | 0.81 | HPGDS (0.62) | HPGDSNQO2KDM4EMCHR1PDE3B | |
| SCHEMBL30081475 | 0.79 | HPGDS (0.60) | HPGDSNQO2KDM4EMCHR1PDE3B | |
| SCHEMBL2134025 | 0.79 | HPGDS (0.60) | HPGDSNQO2KDM4EMCHR1PDE3B | |
| SCHEMBL13255497 | 0.79 | HPGDS (0.60) | HPGDSNQO2KDM4EMCHR1PDE3B | |
| SCHEMBL23858507 | 0.79 | HPGDS (0.60) | HPGDSNQO2KDM4EMCHR1PDE3B | |
| SCHEMBL15034698 | 0.79 | HPGDS (0.60) | HPGDSNQO2KDM4EMCHR1PDE3B | |
| SCHEMBL8811070 | 0.79 | HPGDS (0.56) | HPGDSNQO2MCHR1PDE3BPDE3A | |
| SCHEMBL2671823 | 0.78 | HPGDS (0.72) | HPGDSKDM4ELMNAMAPTMEN1 | |
| SCHEMBL28908417 | 0.78 | METAP2 (0.41) | HPGDSKDM4EALOX12 |
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 |