Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SHBG | P04278 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7765635 | 0.86 | TAAR1 (0.54) | TAAR1TSHRMAPK1SHBGCYP2C19 | |
| SCHEMBL11047013 | 0.81 | TSHR (0.46) | TAAR1TSHRMAPK1CYP2C19HIF1A | |
| SCHEMBL19033678 | 0.81 | TAAR1 (0.60) | TAAR1MAPK1SHBGCYP2C19HIF1A | |
| SCHEMBL42933 | 0.80 | SHBG (0.60) | TAAR1TSHRMAPK1SHBGCYP2C19 | |
| SCHEMBL11047674 | 0.79 | TSHR (0.44) | TAAR1TSHRMAPK1CYP2C19HIF1A | |
| SCHEMBL9245740 | 0.79 | TSHR (0.48) | TAAR1TSHRSHBGESR1ESR2 | |
| Water SCHEMBL28217447 | 0.78 | SHBG (0.58) | TAAR1TSHRMAPK1SHBGCYP2C19 | |
| SCHEMBL2270630 | 0.78 | TAAR1 (0.56) | TAAR1TSHRMAPK1SHBGCYP2C19 | |
| SCHEMBL11045361 | 0.77 | CYP2C19 (0.43) | TAAR1TSHRMAPK1CYP2C19HIF1A | |
| SCHEMBL8529366 | 0.76 | TAAR1 (0.54) | TAAR1TSHRMAPK1SHBGCYP2C19 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-3011024-A | — | — | None | — | — | JP | disclosed |
| 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 |
| JP-H0311024-A | PREPARATION OF GEMINAL DIARYLALKANE, NEW GEMINAL DIARYLALKANE, ALK(EN)YLATED AROMATIC COMPOUND | BAYER AG | 1991-01-18 | — | — | JP | 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 |