Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL4411677 | 0.88 | NPSR1 (0.47) | NPSR1MEN1KMT2ALTA4HEPHX2 | |
| SCHEMBL12229723 | 0.84 | NPSR1 (0.45) | NPSR1MEN1KMT2ALTA4HEPHX2 | |
| SCHEMBL8116136 | 0.82 | LTA4H (0.42) | NPSR1MEN1KMT2ACYP4F2CYP4A11 | |
| SCHEMBL12229683 | 0.81 | POLB (0.53) | NPSR1MEN1KMT2ALTA4HEPHX2 | |
| SCHEMBL12229697 | 0.78 | NPSR1 (0.45) | NPSR1MEN1KMT2ALTA4HEPHX2 | |
| SCHEMBL7525626 | 0.78 | CYP4F2 (0.44) | NPSR1MEN1KMT2ACYP4F2CYP4A11 | |
| SCHEMBL9849286 | 0.75 | LMNA (0.42) | NPSR1MEN1KMT2ACYP4F2CYP4A11 | |
| SCHEMBL9849259 | 0.75 | NPC1 (0.45) | MEN1KMT2ALTA4HEPHX2CA12 | |
| SCHEMBL14809313 | 0.75 | MEN1 (0.48) | NPSR1MEN1KMT2ALTA4HEPHX2 | |
| SCHEMBL12229745 | 0.75 | MEN1 (0.48) | NPSR1MEN1KMT2ALTA4HEPHX2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1268494-A1 | SULFUR SUBSTITUTED ARYLDIFLUOROMETHYLPHOSPHONIC ACIDS AS PTP-1B INHIBITORS | Merck Frosst Canada & Co. (CA) | 2003-01-02 | — | — | EP | disclosed |
| WO-2001070753-A1 | SULFUR SUBSTITUTED ARYLDIFLUOROMETHYLPHOSPHONIC ACIDS AS PTP-1B INHIBITORS | MERCK FROSST CANADA & CO. (CA) | 2001-09-27 | — | — | WO | disclosed |