Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.47 |
| ▸ | TUBB | P07437 | 2/20 | 0.47 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.47 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.47 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.47 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.47 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.47 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.47 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.47 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.47 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.47 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.47 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.47 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.47 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.47 |
| ▸ | HTR2A | P28223 | 2/20 | 0.47 |
| ▸ | HTR2C | P28335 | 2/20 | 0.47 |
| ▸ | HTR2B | P41595 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL25179884 | 0.86 | HTR2A (0.63) | PTGS2HTR2AHTR2CHTR2BCYP19A1 | |
| SCHEMBL27451207 | 0.82 | PTGS2 (0.48) | PTGS2HTR2AHTR2CHTR2BCA2 | |
| SCHEMBL27947309 | 0.80 | NPC1 (0.48) | PTGS2TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL22017083 | 0.79 | PTGS2 (0.45) | PTGS2TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL5185794 | 0.78 | ALDH1A1 (0.48) | PTGS2PTPN1CA2 | |
| SCHEMBL5141794 | 0.78 | ACHE (0.54) | PTGS2TAAR1 | |
| SCHEMBL918847 | 0.77 | PTGS2 (0.59) | PTGS2HTR2AHTR2CHTR2BCA2 | |
| SCHEMBL22035471 | 0.76 | PTGS2 (0.41) | PTGS2TAAR1 | |
| SCHEMBL18540736 | 0.76 | GAA (0.52) | PTGS2CYP19A1TAAR1 | |
| SCHEMBL25845781 | 0.76 | PTGS2 (0.41) | PTGS2CA2TAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103483158-A | Diphenylethane derivatives and application thereof | WUHAN INNERSE PHARMACEUTICALS INC | 2014-01-01 | — | — | CN | claimed |
| CN-103483158-B | A kind of diphenyl ethane derivative and application thereof | 武汉英纳氏药业有限公司 | 2016-06-08 | — | — | CN | disclosed |
| CN-103483158-A | Diphenylethane derivatives and application thereof | WUHAN INNERSE PHARMACEUTICALS INC | 2014-01-01 | — | — | CN | disclosed |