Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2047468 | 0.77 | PDK2 (0.34) | HTR2ALMNATSHRALOX12ACHE | |
| Ammonia Solution, Strong SCHEMBL7083566 | 0.76 | PDK2 (0.33) | HTR2ALMNATSHRALOX12ACHE | |
| SCHEMBL10919330 | 0.75 | KDM4E (0.39) | HTR2AKDM1A | |
| SCHEMBL7941719 | 0.74 | PDK2 (0.33) | LMNATSHRALOX12ACHE | |
| SCHEMBL19981021 | 0.74 | LMNA (0.31) | LMNATSHRALOX12ACHE | |
| SCHEMBL4652584 | 0.74 | LMNA (0.31) | LMNATSHRALOX12ACHE | |
| SCHEMBL22616659 | 0.74 | LMNA (0.31) | LMNATSHRALOX12ACHE | |
| SCHEMBL6351669 | 0.74 | PGR (0.31) | LMNATSHRALOX12ACHE | |
| Hydrochloric Acid SCHEMBL6346400 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL6346406 | 0.72 | PGR (0.30) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2486017-A1 | INDANE-AMINE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICAMENTS | Laboratorios Del. Dr. Esteve, S.A. (ES) | 2012-08-15 | — | — | EP | disclosed |
| WO-2011042343-A1 | INDANE-AMINE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICAMENTS | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2011-04-14 | — | — | WO | disclosed |
| EP-1276739-A2 | HETEROCYCLES THAT ARE INHIBITORS OF IMPDH ENZYME | Bristol-Myers Squibb Company (US) | 2003-01-22 | — | — | EP | disclosed |
| WO-2001081340-A2 | HETEROCYCLES THAT ARE INHIBITORS OF IMPDH ENZYME | BRISTOL-MYERS SQUIBB COMPANY (US) | 2001-11-01 | — | — | WO | disclosed |