Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.56 |
| ▸ | HSD17B3 | P37058 | 3/20 | 0.54 |
| ▸ | PKLR | P30613 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | ESR1 | P03372 | 3/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.51 |
| ▸ | GLA | P06280 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | MAOA | P21397 | 2/20 | 0.51 |
| ▸ | MGAM | O43451 | 1/20 | 0.51 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11848796 | 0.89 | NQO1 (0.56) | PDE2AHSD17B3PKLRNPSR1RXFP1 | |
| SCHEMBL1317544 | 0.77 | PDE2A (0.69) | PDE2AHSD17B3PKLRNPSR1RXFP1 | |
| SCHEMBL1047162 | 0.75 | HSD17B3 (0.46) | HSD17B3MAPTGAAKMT2AMEN1 | |
| SCHEMBL5085550 | 0.74 | MAPK1 (0.51) | HSD17B3MAPTALDH1A1LMNAMAOA | |
| SCHEMBL11839557 | 0.74 | CA12 (0.46) | MAPTGAAKMT2AMEN1KDM4E | |
| SCHEMBL11848821 | 0.74 | GRIN2D (0.55) | MAPTGAAKMT2AMEN1LMNA | |
| SCHEMBL15388494 | 0.74 | NPSR1 (0.56) | PDE2AHSD17B3PKLRNPSR1RXFP1 | |
| SCHEMBL12298179 | 0.73 | LMNA (0.60) | PDE2AHSD17B3MAPTKMT2AMEN1 | |
| SCHEMBL11843916 | 0.73 | GRIN2D (0.53) | MAPTGAAKMT2AMEN1LMNA | |
| SCHEMBL11843907 | 0.73 | GRIN2D (0.53) | MAPTGAAKMT2AMEN1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100488504-C | Coumarin amide derivative, its preparation method, its medicinal composition and application | INST MATERIA MEDICA CAMS (CN) | 2009-05-20 | — | — | CN | disclosed |
| EP-1570846-A1 | THE NOVEL COUMARIN-AMIDE DERIVATIVES AND ITS PREPARATION, SAID DRUG COMPOSITION AND ITS USE | THE INSTITUTE OF MATERIA MEDICA OF CHINESE ACADEMY OF MEDICAL SCIENCES (CN) | 2005-09-07 | — | — | EP | disclosed |