Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 4/20 | 0.50 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GNRHR | P30968 | 6/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12376469 | 0.84 | CHRM1 (0.53) | CHRM1P2RX3HTTKMT2AGNRHR | |
| SCHEMBL7937581 | 0.82 | CHRM1 (0.58) | CHRM1P2RX3KMT2AGNRHRKDM4E | |
| SCHEMBL1931223 | 0.82 | CHRM1 (0.58) | CHRM1P2RX3HTTKMT2AGNRHR | |
| SCHEMBL2490472 | 0.80 | CHRM1 (0.52) | CHRM1HTTKMT2AGNRHRKDM4E | |
| SCHEMBL7921098 | 0.79 | CHRM1 (0.48) | CHRM1P2RX3KMT2AKDM4EALDH1A1 | |
| SCHEMBL2288496 | 0.79 | CHRM1 (0.47) | CHRM1P2RX3KMT2AGNRHRKDM4E | |
| SCHEMBL1550162 | 0.76 | CHRM1 (0.50) | CHRM1P2RX3HTTKMT2AGNRHR | |
| SCHEMBL1550419 | 0.76 | CHRM1 (0.50) | CHRM1P2RX3HTTKMT2AGNRHR | |
| SCHEMBL1931549 | 0.74 | CHRM1 (0.48) | CHRM1P2RX3HTTKMT2AGNRHR | |
| SCHEMBL1931415 | 0.74 | CHRM1 (0.48) | CHRM1P2RX3HTTKMT2AGNRHR |
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 |
|---|---|---|---|---|---|---|---|
| US-8436016-B2 | Fused heterocyclic M1 receptor positive allosteric modulators | Merck, Sharp & Dohme, Corp. | 2013-05-07 | — | — | US | disclosed |