Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | SNCA | P37840 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.33 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9706157 | 0.79 | ADRA2A (0.40) | ADRA2AADRA2BHTR2AKCNH2PGR | |
| SCHEMBL6673796 | 0.76 | ESR1 (0.44) | ADRA2AADRA2BHTR2AKCNH2PGR | |
| SCHEMBL3805684 | 0.75 | KDM4E (0.57) | ADRA2AADRA2BHTR2AKCNH2PGR | |
| SCHEMBL3500698 | 0.75 | SGMS2 (0.52) | NPC1KMT2AMEN1POLBNPSR1 | |
| Acetic Acid SCHEMBL29011401 | 0.73 | KDM4E (0.58) | ADRA2AADRA2BHTR2AKCNH2PGR | |
| SCHEMBL11600086 | 0.73 | CA12 (0.48) | ADRA2AADRA2BKMT2AMEN1HTT | |
| SCHEMBL6032890 | 0.71 | ESR1 (0.56) | ADRA2AADRA2BHTR2AKCNH2PGR | |
| SCHEMBL15570846 | 0.71 | ESR1 (0.56) | ADRA2AADRA2BHTR2AKCNH2PGR | |
| Acetic Acid SCHEMBL28318749 | 0.71 | TSHR (0.57) | ADRA2AKMT2AMEN1POLBNPSR1 | |
| SCHEMBL8899490 | 0.71 | KDM4E (0.64) | ADRA2AADRA2BHTR2AKCNH2PGR |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5665780-A | DEACTIVATING P-GLYCOPROTEIN PUMP IN TUMORS; CANCER TREATMENT | MERRELL PHARMACEUTICALS INC. (US) | 1997-09-09 | — | — | US | claimed |
| EP-0624090-B1 | REVERSAL OF MULTI-DRUG RESISTANCE BY TETRAARYLETHYLENES | MERRELL PHARMA INC (US) | 1996-09-18 | — | — | EP | claimed |
| EP-0624090-A1 | REVERSAL OF MULTI-DRUG RESISTANCE BY TETRAARYLETHYLENES. | MERRELL DOW PHARMA (US) | 1994-11-17 | — | — | EP | claimed |
| WO-1993015733-A1 | REVERSAL OF MULTI-DRUG RESISTANCE BY TETRAARYLETHYLENES | MERRELL DOW PHARMACEUTICALS INC. (US) | 1993-08-19 | — | — | WO | claimed |
| US-5665780-A | DEACTIVATING P-GLYCOPROTEIN PUMP IN TUMORS; CANCER TREATMENT | MERRELL PHARMACEUTICALS INC. (US) | 1997-09-09 | — | — | US | disclosed |
| EP-0624090-B1 | REVERSAL OF MULTI-DRUG RESISTANCE BY TETRAARYLETHYLENES | MERRELL PHARMA INC (US) | 1996-09-18 | — | — | EP | disclosed |
| US-5523304-A | Reversal of multi-drug resistance by tetraarylethylenes | MERRELL PHARMACEUTICALS INC. (US) | 1996-06-04 | — | — | US | disclosed |