Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 9/20 | 0.61 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.61 |
| ▸ | HTR3A | P46098 | 1/20 | 0.46 |
| ▸ | SSTR5 | P35346 | 3/20 | 0.43 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.41 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7985049 | 0.84 | KCNH2 (0.65) | KCNH2NR4A2SSTR5IRAK4MKNK1 | |
| SCHEMBL9534952 | 0.81 | KCNH2 (0.61) | KCNH2NR4A2SSTR5CYP1A2CYP3A4 | |
| SCHEMBL9535562 | 0.81 | KCNH2 (0.60) | KCNH2NR4A2SSTR5CYP3A4CYP2D6 | |
| SCHEMBL13319057 | 0.81 | KCNH2 (0.63) | KCNH2NR4A2SSTR5CYP1A2CYP2C19 | |
| SCHEMBL11265895 | 0.80 | KCNH2 (0.83) | KCNH2NR4A2HTR3ASSTR5CYP1A2 | |
| SCHEMBL6991613 | 0.80 | KCNH2 (0.59) | KCNH2NR4A2 | |
| SCHEMBL7971741 | 0.79 | KCNH2 (0.61) | KCNH2NR4A2HTR3ASSTR5KAT2B | |
| SCHEMBL7971742 | 0.79 | KCNH2 (0.61) | KCNH2NR4A2HTR3ASSTR5KAT2B | |
| SCHEMBL9536919 | 0.79 | KCNH2 (0.58) | KCNH2NR4A2SSTR5 | |
| SCHEMBL5537223 | 0.79 | KCNH2 (0.58) | KCNH2NR4A2HTR3ASSTR5CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6211199-B1 | HISTAMINE AND TACHYKININ RECEPTOR ANTAGONISTS; ANTIASTHMATICS, ANTIEMETICS; RESPIRATORY SYSTEM DISORDERS, INFLAMMATORY BOWEL DISEASE, CONJUNCTIVITIS | AVENTIS PHARMACEUTICALS INC. | 2001-04-03 | — | — | US | disclosed |