Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 3/20 | 0.43 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.38 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.34 |
| ▸ | PYGL | P06737 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27809957 | 0.98 | MTNR1A (0.43) | MTNR1ASMYD3MAPTGAANPC1 | |
| Hydrochloric Acid SCHEMBL16353531 | 0.98 | MTNR1A (0.43) | MTNR1ASMYD3MAPTGAANPC1 | |
| SCHEMBL517885 | 0.83 | SMYD3 (0.43) | MTNR1ASMYD3MAPTGAANPC1 | |
| SCHEMBL5261942 | 0.83 | NPC1 (0.42) | MTNR1ASMYD3MAPTGAANPC1 | |
| SCHEMBL31634875 | 0.83 | SMYD3 (0.43) | MTNR1ASMYD3MAPTGAANPC1 | |
| SCHEMBL7365470 | 0.83 | MTNR1A (0.40) | MTNR1ASMYD3MAPTGAANPC1 | |
| SCHEMBL4215459 | 0.82 | GAA (0.51) | MTNR1ASMYD3MAPTGAACA1 | |
| SCHEMBL17163829 | 0.82 | MTNR1A (0.41) | MTNR1ASMYD3MAPTGAANPC1 | |
| SCHEMBL16618729 | 0.80 | MTNR1A (0.39) | MTNR1ASMYD3MAPTGAANPC1 | |
| Carbamic Acid SCHEMBL1271067 | 0.80 | SMYD3 (0.44) | MTNR1ASMYD3MAPTGAAHTR1A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107098846-A | N- acyl sulfonamides class FBPase inhibitor, its preparation method, pharmaceutical composition and purposes | 中国医学科学院药物研究所 | 2017-08-29 | — | — | CN | disclosed |
| CN-101801194-A | Has 5-HT 63 ' the compound that replaces of receptor affinity | MEMORY PHARM CORP | 2010-08-11 | — | — | CN | disclosed |
| EP-0815103-A1 | TRYPSIN AND THROMBIN INHIBITORS | Novartis AG (CH) | 1998-01-07 | — | — | EP | disclosed |
| WO-1996029327-A1 | TRYPSIN AND THROMBIN INHIBITORS | NOVARTIS AG (CH) | 1996-09-26 | — | — | WO | disclosed |
| CN-1076928-A | 1-[2-arylsulfonyl amino)-and the 1-oxoethyl] piperidine derivative and preparation and the application in treatment | SYNTHELABO (FR) | 1993-10-06 | — | — | CN | disclosed |