Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 3/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.33 |
| ▸ | P4HB | P07237 | 1/20 | 0.32 |
| ▸ | BCL2 | P10415 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8920567 | 0.87 | DHFR (0.38) | DHFRHTR1AHTR3ASLC6A9P4HB | |
| SCHEMBL8919084 | 0.83 | DHFR (0.35) | DHFRHTR1AHTR3ASLC6A9 | |
| SCHEMBL8918041 | 0.78 | DHFR (0.32) | DHFR | |
| SCHEMBL8918979 | 0.78 | DHFR (0.32) | DHFR | |
| SCHEMBL7829348 | 0.76 | NLRP3 (0.31) | — | |
| SCHEMBL8919194 | 0.72 | DHFR (0.38) | DHFRHTR1AHTR3ASLC6A9P4HB | |
| SCHEMBL7825414 | 0.70 | NLRP3 (0.33) | — | |
| SCHEMBL7828017 | 0.70 | PDK2 (0.37) | — | |
| SCHEMBL7824864 | 0.70 | NPC1 (0.31) | — | |
| SCHEMBL7827395 | 0.70 | CYP1A2 (0.33) | — |
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-5691272-A | Carboxylate and heat-sensitive recording material using same | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-11-25 | — | — | US | disclosed |
| US-5559247-A | Carboxylate and heat-sensitive recording material using same | MITSUI TOATSU CHEMICALS, INC. (JP) | 1996-09-24 | — | — | US | disclosed |
| EP-0679640-A1 | Carboxylate and heat-sensitive recording material using same | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1995-11-02 | — | — | EP | disclosed |