Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.54 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.50 |
| ▸ | MMP13 | P45452 | 2/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | IKBKB | O14920 | 1/20 | 0.43 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27703445 | 1.00 | ALDH1A1 (0.55) | ALDH1A1MEN1KMT2ACYP1A2POLB | |
| SCHEMBL14079339 | 0.87 | MEN1 (0.61) | ALDH1A1MEN1KMT2ACYP1A2POLB | |
| SCHEMBL14079337 | 0.86 | ALDH1A1 (0.55) | ALDH1A1MEN1KMT2ACYP1A2POLB | |
| SCHEMBL3953037 | 0.81 | BRD4 (0.52) | ALDH1A1MEN1KMT2ACYP1A2POLB | |
| SCHEMBL14079336 | 0.81 | SERPINE1 (0.50) | ALDH1A1MEN1KMT2ACYP1A2POLB | |
| SCHEMBL3981321 | 0.80 | ALDH1A1 (0.53) | ALDH1A1MEN1KMT2ACYP1A2POLB | |
| SCHEMBL3982872 | 0.79 | ALDH1A1 (0.52) | ALDH1A1MEN1KMT2ACYP1A2POLB | |
| SCHEMBL13872840 | 0.78 | SERPINE1 (0.47) | ALDH1A1MEN1KMT2ACYP1A2POLB | |
| SCHEMBL3961633 | 0.78 | SERPINE1 (0.47) | ALDH1A1MEN1KMT2ACYP1A2POLB | |
| SCHEMBL5149516 | 0.76 | CA1 (0.49) | ALDH1A1MEN1KMT2APOLBSERPINE1 |
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-7417066-B2 | Inhibitors of soluble adenylate cyclase | SCHERING AG (DE) | 2008-08-26 | — | — | US | disclosed |
| US-7417066-B2 | Inhibitors of soluble adenylate cyclase | SCHERING AG (DE) | 2008-08-26 | — | — | US | disclosed |