Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | POLB | P06746 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3635283 | 0.85 | MAPK1 (0.74) | MAPK1TP53MAPTTSHRNPSR1 | |
| SCHEMBL8163764 | 0.81 | GRM5 (0.48) | MAPK1MAPTTSHRALDH1A1SLC6A7 | |
| SCHEMBL4321986 | 0.77 | MEN1 (0.69) | MAPK1TP53MAPTTSHRNPSR1 | |
| SCHEMBL8162119 | 0.76 | GRM5 (0.68) | MAPTTSHRALDH1A1L3MBTL1KDM4E | |
| SCHEMBL8154358 | 0.75 | KDM4E (0.53) | MAPK1MAPTTSHRNPSR1ALDH1A1 | |
| SCHEMBL8160906 | 0.75 | ADRA2C (0.44) | MAPTALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL4317191 | 0.75 | MAPK1 (0.63) | MAPK1TP53MAPTTSHRNPSR1 | |
| SCHEMBL4312385 | 0.74 | MAPK1 (0.62) | MAPK1TP53MAPTTSHRNPSR1 | |
| SCHEMBL4417399 | 0.74 | MEN1 (0.59) | MAPK1TP53MAPTTSHRNPSR1 | |
| SCHEMBL4423124 | 0.74 | ALDH1A1 (0.62) | ALDH1A1KDM4EHPGD |
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-2008151184-A1 | BENZAMIDE MGLUR5 POSITIVE ALLOSTERIC MODULATORS AND METHODS OF MAKING AND USING SAME | VANDERBILT UNIVERSITY (US) | 2008-12-11 | — | — | WO | disclosed |