⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL2016486 | 0.74 | TGFBR1 (0.33) | — | |
| SCHEMBL20198760 | 0.72 | — | — | |
| SCHEMBL28147930 | 0.70 | — | — | |
| SCHEMBL2797317 | 0.70 | — | — | |
| SCHEMBL33800 | 0.70 | — | — | |
| SCHEMBL33799 | 0.70 | — | — | |
| SCHEMBL4099868 | 0.70 | CA2 (0.48) | — | |
| SCHEMBL600767 | 0.70 | CA2 (0.48) | — | |
| SCHEMBL29084669 | 0.69 | CA2 (0.47) | — | |
| Hydrochloric Acid SCHEMBL11786704 | 0.68 | MME (0.38) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20020155533-A1 | PACAP receptor protein, method for preparing said protein, and use thereof | TAKEDA CHEMICAL | 2002-10-24 | — | — | US | disclosed |
| US-6399316-B1 | DRUG SCREENING OF PITUITARY ADENYLATE CYCLASE ACTIVATING POLYPEPTIDE RECEPTOR PROTEIN BY DETECTING CHANGE IN RECEPTOR ACTIVITY IN PRESENCE OR ABSENCE OF TEST COMPOUND | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2002-06-04 | — | — | US | disclosed |
| US-5973117-A | ISOLATED AND PURIFIED RECEPTOR PROTEIN ENDOGENOUS TO RT, BOVINE, OR HUMAN, CAPABLE OF BINDING A PITUITARY ADNEYLATE CYCLASE ACTIVATING POLYPEPTIDE (PACAP) OR SALT, AND AMINO ACID SEQUENCES ENCODING IT; DIAGNOSTIC, E.G. OF NEUROPATHY | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-10-26 | — | — | US | disclosed |
| US-5892004-A | PURIFICATION OF A RECEPTOR PROTEIN CAPABLE OF BINDING A PITUITARY ADENYLATE CYCLASE ACTIVATING POLYPEPTIDE BY AFFINITY CHROMATOGRAPHY USING A BIOTINYLATED PACAP AND ELUTION; RECEPTOR ENDOGENOUS TO A RAT, BOVINE OR HUMAN | TAKEDA CHEMICAL INDUSTRIES LTD. (JP) | 1999-04-06 | — | — | US | disclosed |
| US-5858787-A | AMINO ACID SEQUENCE OF PROTEIN WHICH BINDS PITUITARY ADENYLATE CYCLASE ACTIVATING PROTEIN; FOR CLONING, DRUG SCREENING, GENE DIAGNOSIS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-01-12 | — | — | US | disclosed |
| EP-0618291-A2 | PACAP receptor protein, method for preparing said protein, and use thereof | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-10-05 | — | — | EP | disclosed |