Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.64 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.49 |
| ▸ | NOS3 | P29474 | 1/20 | 0.49 |
| ▸ | NOS1 | P29475 | 1/20 | 0.49 |
| ▸ | NOS2 | P35228 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.47 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.47 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.47 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27993741 | 0.92 | SMN1; SMN2 (0.58) | SMN1; SMN2HRH3TSHRHIF1AEPAS1 | |
| SCHEMBL28295890 | 0.85 | HRH3 (0.59) | HRH3TSHRALDH1A1KDM4E | |
| SCHEMBL28215483 | 0.84 | SIGMAR1 (0.51) | SMN1; SMN2HRH3TSHRHTTALDH1A1 | |
| SCHEMBL28234040 | 0.82 | KDM4E (0.66) | SMN1; SMN2HRH3NOS1HTTHPGD | |
| SCHEMBL28032662 | 0.81 | ALDH1A1 (0.63) | HRH3TSHRHPGDALDH1A1LMNA | |
| SCHEMBL15467001 | 0.80 | HRH3 (0.87) | SMN1; SMN2HRH3HIF1AEPAS1NOS3 | |
| SCHEMBL7931600 | 0.78 | NPC1 (0.61) | SMN1; SMN2HRH3TSHRALDH1A1LMNA | |
| SCHEMBL29127455 | 0.78 | HRH3 (0.54) | SMN1; SMN2HRH3TSHRALDH1A1LMNA | |
| SCHEMBL2545899 | 0.78 | HRH3 (0.65) | SMN1; SMN2HRH3HIF1AEPAS1NOS3 | |
| SCHEMBL5755331 | 0.78 | SMN1; SMN2 (1.00) | SMN1; SMN2HRH3TSHRHIF1AEPAS1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104302624-B | Antimalarial agent | MERCK PATENT GMBH (DE) | 2016-01-13 | — | — | CN | disclosed |
| CN-104302624-A | Anti-malarial agents | UNIV DUNDEE | 2015-01-21 | — | — | CN | disclosed |
| CN-104080769-A | Aryl or heteroaryl substituted benzene compounds | EPIZYME INC | 2014-10-01 | — | — | CN | disclosed |
| CN-101094848-B | Organic compounds | NOVARTIS AG | 2013-03-13 | — | — | CN | disclosed |
| EP-1140896-A1 | BENZOTHIEPIN-ANILIDE DERIVATIVES, THEIR PRODUCTION AND THEIR USE FOR ANTAGONIZING CCR-5 | Takeda Chemical Industries, Ltd. (JP) | 2001-10-10 | — | — | EP | disclosed |
| US-6235771-B1 | AIDS THERPAY | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-05-22 | — | — | US | disclosed |
| WO-2000037455-A1 | BENZOTHIEPIN-ANILIDE DERIVATIVES, THEIR PRODUCTION AND THEIR USE FOR ANTAGONIZING CCR-5 | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2000-06-29 | — | — | WO | disclosed |