Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 9/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6496428 | 0.89 | CFTR (0.47) | CFTRKDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL6504965 | 0.88 | CFTR (0.53) | CFTRKDM4EMEN1KMT2ANPSR1 | |
| Acetic Acid SCHEMBL6502120 | 0.87 | CFTR (0.46) | CFTRKDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL6496683 | 0.87 | CFTR (0.46) | CFTRKDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL6277839 | 0.87 | CFTR (0.47) | CFTRKDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL6278814 | 0.87 | CFTR (0.51) | CFTRKDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL6280476 | 0.86 | CFTR (0.47) | CFTRKDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL6278853 | 0.86 | CFTR (0.46) | CFTRKDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL6280736 | 0.85 | CFTR (0.47) | CFTRKDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL6280325 | 0.85 | CFTR (0.44) | CFTRKDM4EMEN1KMT2ANPSR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005048916-A2 | TETRAHYDROSPIRO-BETA-CARBOLINE-1,3 '-PYRROLIDINE DERIVATIVES AND THEIR USE IN GHSR-RELATED DISORDERS | BIOVITRUM AB (SE) | 2005-06-02 | — | — | WO | disclosed |