Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 3/20 | 0.40 |
| ▸ | NOS1 | P29475 | 2/20 | 0.40 |
| ▸ | NOS2 | P35228 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.35 |
| ▸ | CCKBR | P32239 | 1/20 | 0.35 |
| ▸ | MC4R | P32245 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6542282 | 0.87 | MEN1 (0.41) | KDM4EGAANPC1HTTRAB9A | |
| SCHEMBL4280650 | 0.87 | MEN1 (0.41) | KDM4EGAANPC1HTTRAB9A | |
| SCHEMBL8557974 | 0.87 | MEN1 (0.41) | KDM4EGAANPC1HTTRAB9A | |
| SCHEMBL9026507 | 0.87 | MEN1 (0.41) | KDM4EGAANPC1HTTRAB9A | |
| Masoprocol SCHEMBL6246633 | 0.80 | KMT2A (0.37) | KDM4ENPC1HTTRAB9ASMN1; SMN2 | |
| SCHEMBL8817118 | 0.80 | PTGDR2 (0.40) | NOS2CHRM2CHRM3 | |
| SCHEMBL10516186 | 0.77 | MEN1 (0.43) | KDM4EGAANPC1HTTRAB9A | |
| SCHEMBL8817089 | 0.77 | KDM4E (0.42) | KDM4EGAANPC1HTTRAB9A | |
| SCHEMBL8817083 | 0.76 | OGT (0.40) | KDM4ENPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL9212414 | 0.76 | HTT (0.40) | KDM4EGAANPC1HTTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-5968969-A | BENZATHINE AND LIDOCAINE SALTS OF SELECTED CARBOXAMIDES FOR INTRA-ARTICULAR INJECTION | PFIZER INC (US) | 1999-10-19 | — | — | US | disclosed |
| EP-0826685-A1 | Stable, long acting salts of carboxamides for the treatment of joint disease | PFIZER INC. (US) | 1998-03-04 | — | — | EP | disclosed |
| WO-1997022605-A1 | STABLE, LONG ACTING SALTS OF INDOLE DERIVATIVES FOR THE TREATMENT OF JOINT DISEASES | PFIZER INC. (US) | 1997-06-26 | — | — | WO | disclosed |