Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 6/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7415245 | 0.82 | NPC1 (0.50) | RIPK1RAB9ASMN1; SMN2NPC1MAPT | |
| SCHEMBL7428336 | 0.73 | TRPM8 (0.47) | RIPK1NPSR1HSD11B1RAB9ASMN1; SMN2 | |
| SCHEMBL12313812 | 0.69 | RIPK1 (0.63) | RIPK1NPSR1HSD11B1RAB9ASMN1; SMN2 | |
| SCHEMBL21400322 | 0.68 | RIPK1 (0.62) | RIPK1NPSR1HSD11B1RAB9ASMN1; SMN2 | |
| Carbamic Acid SCHEMBL27383793 | 0.68 | POLB (0.55) | RIPK1RAB9ASMN1; SMN2NPC1POLB | |
| SCHEMBL13870657 | 0.68 | RIPK1 (0.57) | RIPK1NPSR1TSHRHSD11B1RAB9A | |
| SCHEMBL6122487 | 0.67 | RIPK1 (0.60) | RIPK1NPSR1HSD11B1RAB9ASMN1; SMN2 | |
| SCHEMBL3325606 | 0.65 | RIPK1 (0.66) | RIPK1NPSR1HSD11B1RAB9ASMN1; SMN2 | |
| SCHEMBL3323893 | 0.65 | RIPK1 (0.75) | RIPK1NPSR1HSD11B1RAB9ASMN1; SMN2 | |
| SCHEMBL7093269 | 0.65 | CLCN2 (0.40) | NPSR1TSHRRAB9ANPC1CYP3A4 |
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-1265903-A1 | THIEPINO[3,2-B]DIHYDROPYRIDINES AND RELATED COMPOSITIONS AND METHODS | Ortho-Mcneil Pharmaceutical, Inc. (US) | 2002-12-18 | — | — | EP | disclosed |
| US-6420383-B1 | CALCIUM CHANNEL BLOCKERS, HYPERSENSITIVITY, ALLERGY, ASTHMA, BRONCHOSPASM, DYSMENORRHEA, ESOPHAGEAL SPASM, GLAUCOMA, PREMATURE LABOR, URINARY TRACT DISORDERS, GASTROINTESTINAL MOTILITY DISORDERS AND CARDIOVASCULAR DISORDERS. | ORTHO-MCNEIL PHARMACEUTICAL, INC. | 2002-07-16 | — | — | US | disclosed |
| WO-2001070748-A1 | THIEPINO [3,2-b] DIHYDROPYRIDINES AND RELATED COMPOSITIONS AND METHODS | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2001-09-27 | — | — | WO | disclosed |