Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL5284539 | 0.82 | KCNN4 (0.37) | KCNN4HTR2AHTR2CADRA1AOPRK1 | |
| SCHEMBL9249193 | 0.80 | ALDH1A1 (0.54) | TSHRLMNAALDH1A1TDP1POLB | |
| SCHEMBL11047342 | 0.77 | TSHR (0.48) | TSHRALDH1A1TDP1CYP3A4 | |
| SCHEMBL5276758 | 0.75 | KCNN4 (0.41) | KCNN4HTR2AHTR2CADRA1AOPRK1 | |
| SCHEMBL9250883 | 0.73 | TRPA1 (0.42) | HTR2AHTR2CLMNAALDH1A1TDP1 | |
| SCHEMBL9244761 | 0.72 | ALDH1A1 (0.41) | KCNN4TSHRALDH1A1HIF1ACYP3A4 | |
| SCHEMBL30530487 | 0.72 | KCNN4 (0.45) | KCNN4HTR2AHTR2CADRA1AOPRK1 | |
| SCHEMBL8895713 | 0.72 | KCNN4 (0.45) | KCNN4HTR2AHTR2CADRA1AOPRK1 | |
| SCHEMBL4298643 | 0.72 | KCNN4 (0.45) | KCNN4HTR2AHTR2CADRA1AOPRK1 | |
| SCHEMBL78489 | 0.71 | TSHR (0.50) | KCNN4HTR2AHTR2CADRA1AOPRK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0399284-B1 | Method for the production of geminal diarylalkanes, geminal diarylalkanes and alk(en)ylated aromatic compounds | BAYER AG (DE) | 1995-08-02 | — | — | EP | disclosed |
| US-5136114-A | PROCESS FOR THE PREPARATION OF GEMINAL DIARYLALKANES, NEW GEMINAL DIARYLALKANES AND ALK(EN)YLATED AROMATIC COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-04 | — | — | US | disclosed |
| EP-0399284-A2 | Method for the production of geminal diarylalkanes, geminal diarylalkanes and alk(en)ylated aromatic compounds | BAYER AG (DE) | 1990-11-28 | — | — | EP | disclosed |