Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 8/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | XBP1 | P17861 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7843467 | 0.92 | HCRTR1 (0.47) | HCRTR1HCRTR2TRPV1ACHELMNA | |
| SCHEMBL7852667 | 0.90 | HCRTR1 (0.44) | HCRTR1HCRTR2TRPV1ACHELMNA | |
| Hydrochloric Acid SCHEMBL7855751 | 0.90 | HCRTR1 (0.44) | HCRTR1HCRTR2TRPV1ACHELMNA | |
| Hydrochloric Acid SCHEMBL7855468 | 0.90 | HCRTR1 (0.44) | HCRTR1HCRTR2TRPV1ACHELMNA | |
| Hydrochloric Acid SCHEMBL7843496 | 0.90 | HCRTR1 (0.44) | HCRTR1HCRTR2TRPV1ACHELMNA | |
| Hydrochloric Acid SCHEMBL7848773 | 0.89 | HCRTR1 (0.42) | HCRTR1HCRTR2TRPV1ACHELMNA | |
| Hydrochloric Acid SCHEMBL7852742 | 0.87 | HCRTR1 (0.45) | HCRTR1HCRTR2ACHELMNATP53 | |
| Hydrochloric Acid SCHEMBL7847363 | 0.86 | HCRTR1 (0.46) | HCRTR1HCRTR2ACHELMNATP53 | |
| SCHEMBL7853411 | 0.85 | HCRTR1 (0.50) | HCRTR1HCRTR2LMNATP53 | |
| Hydrochloric Acid SCHEMBL7848616 | 0.85 | HCRTR1 (0.46) | HCRTR1HCRTR2ACHELMNATP53 |
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-1129076-A1 | TETRAHYDROISOQUINOLINE DERIVATIVES AS LHRH ANTAGONISTS | ABBOTT LABORATORIES (US) | 2001-09-05 | — | — | EP | disclosed |
| WO-2000029380-A1 | TETRAHYDROISOQUINOLINE DERIVATIVES AS LHRH ANTAGONISTS | ABBOTT LABORATORIES (US) | 2000-05-25 | — | — | WO | disclosed |
| US-5981521-A | USEFUL FOR TREATING VARIOUS HORMONE DEPENDENT DISEASES, INCLUDING PROSTATE CANCER, ENDOMETRIOSIS, UTERINE FIBROIDS, PRECOCIOUS PUBERTY, BENIGN PROSTATE HYPERTROPY AND IN VITRO FERTILIZATION | ABBOTT LABORATORIES (US) | 1999-11-09 | — | — | US | disclosed |