Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | DRD1 | P21728 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | PTGIR | P43119 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 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 | |
|---|---|---|---|---|
| SCHEMBL15825900 | 0.90 | DRD2 (0.47) | ALDH1A1HRH3DRD2PTGIR | |
| SCHEMBL5147435 | 0.81 | HRH3 (0.60) | ALDH1A1KMT2AGFERHRH3SIGMAR1 | |
| SCHEMBL7251010 | 0.78 | ALDH1A1 (0.58) | ALDH1A1KMT2AGFERHRH3SIGMAR1 | |
| SCHEMBL3038951 | 0.75 | HPGD (0.44) | ALDH1A1KMT2AKDM4E | |
| SCHEMBL28557449 | 0.73 | HPGD (0.47) | ALDH1A1 | |
| SCHEMBL4518449 | 0.73 | HTT (0.44) | ALDH1A1KMT2A | |
| SCHEMBL2796840 | 0.72 | TSHR (0.44) | ALDH1A1KMT2AKDM4E | |
| SCHEMBL7244646 | 0.71 | NPC1 (0.49) | ALDH1A1KMT2AHRH3SIGMAR1LTA4H | |
| SCHEMBL3066309 | 0.71 | KDM4E (0.55) | ALDH1A1KMT2AHRH3KDM4EHRH4 | |
| SCHEMBL4930913 | 0.71 | SIGMAR1 (0.50) | HRH3SIGMAR1LTA4H |
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 |
|---|---|---|---|---|---|---|---|
| EP-2585470-A2 | NOVEL FUSED PYRIMIDINE DERIVATIVES FOR INHD3ITION OF TYROSINE KINASE ACTIVITY | Hanmi Science Co., Ltd. (KR) | 2013-05-01 | — | — | EP | disclosed |
| WO-2011162515-A2 | NOVEL FUSED PYRIMIDINE DERIVATIVES FOR INHD3ITION OF TYROSINE KINASE ACTIVITY | HANMI HOLDINGS CO. , LTD. (KR) | 2011-12-29 | — | — | WO | disclosed |