Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 3/20 | 0.40 |
| ▸ | KCNA3 | P22001 | 2/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | ERBB2 | P04626 | 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 | |
|---|---|---|---|---|
| SCHEMBL11763313 | 0.97 | KCNN4 (0.39) | KCNN4KCNA3KIF11HTR2AHTR2C | |
| SCHEMBL11761668 | 0.91 | KCNN4 (0.47) | KCNN4KCNA3KIF11HTR2AHTR2C | |
| SCHEMBL11864536 | 0.79 | NPC1 (0.36) | KCNN4HTR2AHTR2COPRK1KCNH2 | |
| SCHEMBL11764452 | 0.79 | CHRM2 (0.33) | KIF11CHRM2CYP3A4CHRM1CHRM3 | |
| SCHEMBL11765634 | 0.78 | CYP3A4 (0.40) | CYP3A4 | |
| SCHEMBL5961207 | 0.76 | KCNN4 (0.31) | KCNN4CYP2C9TSHR | |
| SCHEMBL11864540 | 0.75 | CYP3A4 (0.33) | KCNN4KIF11CYP3A4 | |
| SCHEMBL11657467 | 0.74 | CYP3A4 (0.34) | KIF11MEN1ABCB11LMNACYP1A2 | |
| SCHEMBL15413 | 0.73 | KCNN4 (0.36) | KCNN4CA2CYP1A2MAPTALOX15 | |
| SCHEMBL1149592 | 0.73 | KCNN4 (0.36) | KCNN4CA2CYP1A2MAPTALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| US-4035318-A | BISDIISOCYANATOBENZYLCHLOROBENZENE | OLIN CORPORATION (US) | 1977-07-12 | — | — | US | disclosed |
| US-3952043-A | CROSSLINKING AGENTS FOR POLYURETHANES | OLIN CORPORATION (US) | 1976-04-20 | — | — | US | disclosed |