Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | STAT3 | P40763 | 1/20 | 0.48 |
| ▸ | GPR3 | P46089 | 1/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.41 |
| ▸ | ERN1 | O75460 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL862361 | 0.82 | PDE3B (0.49) | ALDH1A1HPGDGPR3CYP1A2OPRM1 | |
| SCHEMBL27600483 | 0.81 | ALDH1A1 (0.46) | ALDH1A1HPGDGAAKDM4ESTAT3 | |
| SCHEMBL19700637 | 0.77 | GPR3 (0.44) | ALDH1A1HPGDGAAKDM4ESTAT3 | |
| SCHEMBL28042222 | 0.77 | ALDH1A1 (0.56) | ALDH1A1HPGDGAAKDM4EGPR3 | |
| SCHEMBL29923623 | 0.77 | BACE1 (0.47) | ALDH1A1HPGDGAAKDM4ESTAT3 | |
| SCHEMBL24916325 | 0.77 | BACE1 (0.47) | ALDH1A1HPGDGAAKDM4ESTAT3 | |
| SCHEMBL15119531 | 0.77 | ALDH1A1 (0.58) | ALDH1A1HPGDGAAKDM4ESTAT3 | |
| SCHEMBL28073764 | 0.77 | PDE10A (0.47) | ALDH1A1HPGDKDM4EHSD17B10PDE10A | |
| SCHEMBL24915591 | 0.74 | DHFR (0.48) | ALDH1A1HPGDGPR3CYP1A2OPRM1 | |
| SCHEMBL28492152 | 0.74 | KDM4E (0.47) | ALDH1A1HPGDGAAKDM4ECYP1A2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101747336-B | Novel method for synthesizing Repirinast | JIANGSU JUMPCAN MEDICINES CO LTD | 2012-07-18 | — | — | CN | claimed |
| CN-101747336-A | Novel method for synthesizing Repirinast | JIANGSU JUMPCAN MEDICINES CO L | 2010-06-23 | — | — | CN | claimed |
| CN-101747336-B | Novel method for synthesizing Repirinast | JIANGSU JUMPCAN MEDICINES CO LTD | 2012-07-18 | — | — | CN | disclosed |
| CN-101316591-B | Quinoline compound and pharmaceutical application thereof | ARGENTA ORAL THERAPEUTICS LTD. (GB) | 2012-02-01 | — | — | CN | disclosed |
| CN-101747336-A | Novel method for synthesizing Repirinast | JIANGSU JUMPCAN MEDICINES CO L | 2010-06-23 | — | — | CN | disclosed |
| CN-101316591-A | Quinolines and their therapeutic use | ARGENTA DISCOVERY LTD (GB) | 2008-12-03 | — | — | CN | disclosed |
| WO-1995021825-A1 | 6-ARYL-(METHYL- OR METHYLIDONE)-QUINOLINE DERIVATIVES AS VOLTAGE-GATED POTASSIUM CHANNEL BLOCKERS | JOHN WYETH & BROTHER LTD. (GB) | 1995-08-17 | — | — | WO | disclosed |
| EP-0363212-A2 | Novel heterocyclic compounds and anticancer-drug reinforcing agents containing them as effective components | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1990-04-11 | — | — | EP | disclosed |