Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.51 |
| ▸ | P4HB | P07237 | 1/20 | 0.51 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 0.45 |
| ▸ | CSF1R | P07333 | 2/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.44 |
| ▸ | VNN1 | O95497 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8645512 | 1.00 | TSHR (0.54) | TSHRMEN1KMT2ATBXAS1P4HB | |
| SCHEMBL8650840 | 0.82 | TSHR (0.49) | TSHRMEN1KMT2ATBXAS1P4HB | |
| SCHEMBL3966289 | 0.81 | AKR1C3 (0.58) | MEN1KMT2AP4HBMAOBAKR1C1 | |
| SCHEMBL3966293 | 0.81 | AKR1C3 (0.58) | MEN1KMT2AP4HBMAOBAKR1C1 | |
| SCHEMBL4576463 | 0.81 | AKR1C3 (0.58) | MEN1KMT2AP4HBMAOBAKR1C1 | |
| SCHEMBL8646379 | 0.81 | AKR1C1 (0.68) | MEN1KMT2ATBXAS1AKR1C1ALDH1A1 | |
| SCHEMBL8646375 | 0.81 | AKR1C1 (0.68) | MEN1KMT2ATBXAS1AKR1C1ALDH1A1 | |
| SCHEMBL8649420 | 0.81 | AKR1C3 (0.56) | MEN1KMT2AALOX15NPSR1AKR1C1 | |
| SCHEMBL8649414 | 0.81 | AKR1C3 (0.56) | MEN1KMT2AALOX15NPSR1AKR1C1 | |
| SCHEMBL8643115 | 0.78 | ALDH1A1 (0.59) | MEN1KMT2AAKR1C1ALDH1A1CYP1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0861831-A1 | HETEROARYL-SUBSTITUTED ACRYLOYLGUANIDINE DERIVATIVES AND MEDICINAL COMPOSITION THEREOF | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1998-09-02 | — | — | EP | disclosed |