Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 15/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 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 | |
|---|---|---|---|---|
| SCHEMBL9625041 | 0.87 | SMPD1 (0.45) | SIGMAR1CYP1A2CYP2D6CYP3A4 | |
| SCHEMBL9623557 | 0.86 | SIGMAR1 (0.40) | SIGMAR1DRD2DRD3 | |
| SCHEMBL9624476 | 0.81 | MAPT (0.38) | SIGMAR1DRD2DRD3LTA4HCYP3A4 | |
| SCHEMBL9625873 | 0.81 | SMPD1 (0.35) | SIGMAR1DRD2DRD3LTA4HCYP3A4 | |
| SCHEMBL9624612 | 0.78 | LMNA (0.46) | SIGMAR1TSHR | |
| SCHEMBL9623887 | 0.76 | HDAC6 (0.34) | DRD2DRD3LTA4HCYP3A4 | |
| SCHEMBL9624635 | 0.76 | CHRNA7 (0.49) | SIGMAR1 | |
| SCHEMBL9624963 | 0.75 | HDAC6 (0.34) | SIGMAR1DRD2DRD3LTA4HCYP3A4 | |
| SCHEMBL9624528 | 0.75 | LMNA (0.46) | SIGMAR1DRD3TSHR | |
| SCHEMBL9625068 | 0.74 | HDAC6 (0.35) | SIGMAR1DRD2DRD3LTA4HCYP3A4 |
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-5116986-A | HETEROAROMATIC AMINE DERIVATIVES | DR. KARL THOMAE GMBH (DE) | 1992-05-26 | — | — | US | disclosed |
| US-4912115-A | Cardiovascular disorders | DR. KARL THOMAE GMBH (DE) | 1990-03-27 | — | — | US | disclosed |