Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 1/20 | 0.46 |
| ▸ | CTSL | P07711 | 2/20 | 0.46 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | CTSS | P25774 | 1/20 | 0.46 |
| ▸ | CTSK | P43235 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PPID | Q08752 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7460122 | 0.88 | CTSL (0.48) | CAPN1CTSLCTSBCTSSCTSK | |
| SCHEMBL14280789 | 0.84 | MEN1 (0.48) | CTSSCTSKCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8977043 | 0.84 | MEN1 (0.54) | CAPN1CTSLCTSBCTSSCTSK | |
| SCHEMBL8976845 | 0.83 | CAPN1 (0.47) | CAPN1CTSLCTSBCTSSCTSK | |
| SCHEMBL15374288 | 0.82 | CYP1A2 (0.59) | CAPN1CTSLCTSBCTSSCTSK | |
| SCHEMBL15107084 | 0.82 | CYP1A2 (0.59) | CAPN1CTSLCTSBCTSSCTSK | |
| SCHEMBL9596442 | 0.82 | CYP1A2 (0.59) | CAPN1CTSLCTSBCTSSCTSK | |
| SCHEMBL8017762 | 0.81 | CYP1A2 (0.49) | CAPN1CTSLCTSBCTSSCTSK | |
| Hydrochloric Acid SCHEMBL30231858 | 0.80 | CAPN1 (0.46) | CAPN1CTSLCTSBCTSSCTSK | |
| SCHEMBL10743743 | 0.78 | PPID (0.43) | CAPN1CTSLCTSBKMT2AGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0706532-B1 | Peptides having endothelin antagonictic activity,their preparation and pharmaceutical compositions | FUJISAWA PHARMACEUTICAL CO (JP) | 2000-02-02 | — | — | EP | disclosed |
| EP-0706532-A1 | NEW COMPOUND AND ITS PREPARATION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-04-17 | — | — | EP | disclosed |
| WO-1995000537-A1 | NEW COMPOUND AND ITS PREPARATION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1995-01-05 | — | — | WO | disclosed |