Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.39 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11629438 | 1.00 | KCNH2 (0.50) | KCNH2MEN1KMT2ABCHECYP1A2 | |
| SCHEMBL3301329 | 0.89 | MEN1 (0.61) | KCNH2MEN1KMT2ACYP1A2CYP2D6 | |
| SCHEMBL3037072 | 0.89 | MEN1 (0.61) | KCNH2MEN1KMT2ACYP1A2CYP2D6 | |
| SCHEMBL11387658 | 0.81 | KCNH2 (0.47) | KCNH2MEN1KMT2ACYP1A2CYP2D6 | |
| SCHEMBL11496361 | 0.81 | EPOR (0.52) | KCNH2MEN1KMT2AALDH1A1 | |
| Sulfuric Acid SCHEMBL9223828 | 0.79 | MEN1 (0.51) | KCNH2MEN1KMT2ABCHECYP1A2 | |
| SCHEMBL11252486 | 0.79 | CA1 (0.48) | KCNH2CYP1A2CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL29624528 | 0.79 | CA1 (0.48) | KCNH2CYP1A2CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL9779068 | 0.77 | MEN1 (0.53) | KCNH2MEN1KMT2ABCHECYP1A2 | |
| SCHEMBL2774560 | 0.76 | MEN1 (0.63) | KCNH2MEN1KMT2ACYP1A2CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4104383-A | PSYCHOSTIMULANT, ANTISPASMODIC, HYPOTENSIVE, ANALGESIC | C M INDUSTRIES (FR) | 1978-08-01 | — | — | US | claimed |
| US-4104383-A | PSYCHOSTIMULANT, ANTISPASMODIC, HYPOTENSIVE, ANALGESIC | C M INDUSTRIES (FR) | 1978-08-01 | — | — | US | disclosed |