Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.65 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | USP2 | O75604 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | ACACB | O00763 | 1/20 | 0.49 |
| ▸ | ACACA | Q13085 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Ethane SCHEMBL6101984 | 0.94 | KDM4E (0.62) | KDM4EHIF1AALDH1A1L3MBTL1USP2 | |
| SCHEMBL6100437 | 0.90 | KDM4E (0.56) | KDM4EHIF1AALDH1A1L3MBTL1USP2 | |
| Ethane SCHEMBL6097651 | 0.87 | KDM4E (0.71) | KDM4EHIF1AALDH1A1L3MBTL1USP2 | |
| SCHEMBL6101980 | 0.85 | KDM4E (0.55) | KDM4EHIF1AALDH1A1L3MBTL1USP2 | |
| Ethane SCHEMBL6097475 | 0.84 | KDM4E (0.77) | KDM4EHIF1AALDH1A1L3MBTL1USP2 | |
| Ethane SCHEMBL6099926 | 0.83 | KDM4E (0.75) | KDM4EHIF1AALDH1A1L3MBTL1USP2 | |
| Ethane SCHEMBL6112019 | 0.83 | KDM4E (0.59) | KDM4EHIF1AALDH1A1L3MBTL1USP2 | |
| Ethane SCHEMBL6102425 | 0.82 | KDM4E (0.73) | KDM4EHIF1AALDH1A1L3MBTL1USP2 | |
| Ethane SCHEMBL6099689 | 0.81 | KDM4E (0.69) | KDM4EHIF1AALDH1A1L3MBTL1USP2 | |
| Ethane SCHEMBL6099875 | 0.81 | KDM4E (0.95) | KDM4EHIF1AALDH1A1L3MBTL1USP2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7041664-B2 | 2-aminoquinolinecarboxamides: neurokinin receptor ligands | NEUROGEN CORPORATION (US) | 2006-05-09 | — | — | US | disclosed |
| US-6894044-B2 | 2-aminoquinolinecarboxamides: neurokinin receptor ligands | NEUROGEN CORPORATION (US) | 2005-05-17 | — | — | US | disclosed |
| US-6369053-B1 | CENTRAL NERVOUS SYSTEM AND PERIPHERAL DISEASES; ALSO USEFUL AS PROBES FOR THE LOCALIZATION OF CELL SURFACE RECEPTORS; NONPEPTIDE NK-3 RECEPTOR ANTAGONISTS | NEUROGEN CORPORATION | 2002-04-09 | — | — | US | disclosed |