Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 6/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 SCHEMBL7855411 | 1.00 | TP53 (0.39) | TP53LMNAMTNR1BMTNR1AALOX5 | |
| SCHEMBL7854768 | 0.93 | TP53 (0.38) | TP53LMNAMTNR1BALOX5HDAC3 | |
| Hydrochloric Acid SCHEMBL7854514 | 0.93 | TP53 (0.38) | TP53LMNAMTNR1BALOX5HDAC3 | |
| Hydrochloric Acid SCHEMBL7854779 | 0.93 | TP53 (0.42) | TP53LMNAMTNR1BHCRTR1HCRTR2 | |
| Hydrochloric Acid SCHEMBL7847146 | 0.91 | HCRTR1 (0.40) | TP53LMNAMTNR1BMTNR1AHDAC3 | |
| Hydrochloric Acid SCHEMBL7845209 | 0.90 | LMNA (0.40) | TP53LMNAMTNR1BMTNR1AALOX5 | |
| SCHEMBL7838649 | 0.89 | LMNA (0.41) | TP53LMNAMTNR1BMTNR1AALOX5 | |
| Hydrochloric Acid SCHEMBL7855697 | 0.87 | LMNA (0.40) | TP53LMNAMTNR1BMTNR1AALOX5 | |
| Hydrochloric Acid SCHEMBL7847363 | 0.85 | HCRTR1 (0.46) | TP53LMNAMTNR1BHCRTR1HCRTR2 | |
| Hydrochloric Acid SCHEMBL7853340 | 0.84 | HCRTR1 (0.41) | TP53LMNAMTNR1BHDAC3HDAC8 |
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 |