Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKDC | P78527 | 2/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HTR7 | P34969 | 3/20 | 0.47 |
| ▸ | HTR6 | P50406 | 2/20 | 0.47 |
| ▸ | NCF1 | P14598 | 2/20 | 0.47 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.47 |
| ▸ | HTR3B | O95264 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | HTR1D | P28221 | 1/20 | 0.47 |
| ▸ | HTR1B | P28222 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | HTR5A | P47898 | 1/20 | 0.47 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9229213 | 0.78 | KMT2A (0.57) | KMT2ANCF1HTR1AHTR2AALDH1A1 | |
| SCHEMBL9229904 | 0.77 | ADRB1 (0.51) | ADRB1HTR7HTR6NCF1HTR3E | |
| Hydrochloric Acid SCHEMBL9229290 | 0.76 | ADRB1 (0.50) | ADRB1HTR7HTR6NCF1HTR3E | |
| Batoprazine SCHEMBL766463 | 0.76 | HTR5A (0.53) | ADRB1HTR7HTR6NCF1HTR3E | |
| Formamide SCHEMBL27876319 | 0.74 | ADRB1 (0.48) | ADRB1HTR7HTR6NCF1HTR3E | |
| SCHEMBL5904424 | 0.72 | KMT2A (0.64) | PRKDCKMT2ACYP1A2TSHRHSD17B10 | |
| SCHEMBL30940063 | 0.72 | KMT2A (0.64) | PRKDCKMT2ACYP1A2TSHRHSD17B10 | |
| SCHEMBL5203993 | 0.71 | PRKDC (0.73) | PRKDCHTR7HTR6NCF1HTR3E | |
| SCHEMBL1443282 | 0.71 | DRD2 (0.56) | ADRB1HTR6HTR1AHTR2A | |
| SCHEMBL16156549 | 0.71 | ADRB1 (0.69) | ADRB1HTR7HTR6NCF1HTR3E |
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-1105360-A | 1-[2H-1-benzopyran-2-one-8yl]-piperazin derivative | DUPHAR INT RES (NL) | 1995-07-19 | — | — | CN | disclosed |
| EP-0650964-A1 | 1 2H-1-benzopyran-2-one-8-yl -piperazine derivatives | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1995-05-03 | — | — | EP | disclosed |