Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.58 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.53 |
| ▸ | SORD | Q00796 | 2/20 | 0.52 |
| ▸ | ACHE | P22303 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | DRD4 | P21917 | 1/20 | 0.50 |
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL8149109 | 0.93 | HRH4 (0.51) | MEN1KMT2AHRH4HTR2CMAPT | |
| SCHEMBL6232120 | 0.91 | HRH4 (0.62) | HRH4HTR2CMAPTKDM4ENPSR1 | |
| SCHEMBL3684916 | 0.88 | KDM4E (0.59) | MEN1KMT2AHRH4HTR2CMAPT | |
| SCHEMBL8486348 | 0.88 | HRH4 (0.60) | MEN1KMT2AHRH4HTR2CMAPT | |
| SCHEMBL8130723 | 0.88 | SIGMAR1 (0.58) | MEN1KMT2AHRH4HTR2CMAPT | |
| SCHEMBL8124752 | 0.86 | KMT2A (0.57) | KMT2AHRH4HTR2CMAPTKDM4E | |
| SCHEMBL8118469 | 0.85 | HRH4 (0.53) | MEN1KMT2AHRH4HTR2CMAPT | |
| Hydrochloric Acid SCHEMBL8110649 | 0.85 | KMT2A (0.56) | KMT2AHRH4HTR2CMAPTKDM4E | |
| SCHEMBL3684760 | 0.85 | HTR3E (0.53) | MEN1KMT2AHTR2CMAPTKDM4E | |
| Hydrochloric Acid SCHEMBL31587046 | 0.84 | HRH4 (0.55) | HRH4HTR2CMAPTKDM4ESORD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0970054-A1 | 1-(ISOQUINOLIN-1-YL)-4-(1-PHENYLMETHYL)PIPERAZINES; DOPAMINE RECEPTOR SUBTYPE SPECIFIC LIGANDS | NEUROGEN CORPORATION (US) | 2000-01-12 | — | — | EP | claimed |
| US-6008352-A | USEFUL IN TREATING PSYCHOTIC DISORDERS SUCH AS SCHIZOPHRENIA AND OTHER CENTRAL NERVOUS SYSTEM DISEASES | NEUROGEN CORPORATION (US) | 1999-12-28 | — | — | US | claimed |
| WO-1998039301-A1 | 1-(ISOQUINOLIN-1-YL)-4-(1-PHENYLMETHYL)PIPERAZINES; DOPAMINE RECEPTOR SUBTYPE SPECIFIC LIGANDS | NEUROGEN CORPORATION (US) | 1998-09-11 | — | — | WO | claimed |