Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.58 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.56 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.51 |
| ▸ | AR | P10275 | 6/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.50 |
| ▸ | HTR7 | P34969 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL4291189 | 0.85 | ADRB1 (0.72) | LMNAMCOLN3ADRB1AKR1C3AR | |
| SCHEMBL11093152 | 0.82 | ADRA2C (0.58) | LMNASMN1; SMN2 | |
| SCHEMBL28587090 | 0.80 | ADRB1 (0.60) | LMNAMCOLN3ADRB1AKR1C3AR | |
| SCHEMBL11091267 | 0.80 | SMN1; SMN2 (0.50) | LMNAADRB1ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL1361268 | 0.78 | ADRB1 (0.58) | LMNAMCOLN3ADRB1AKR1C3AR | |
| SCHEMBL11092868 | 0.78 | HRH3 (0.44) | ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL11096500 | 0.78 | CHRNA7 (0.59) | SMN1; SMN2 | |
| SCHEMBL11093160 | 0.78 | GRIN2D (0.43) | LMNAMCOLN3ALDH1A1SMN1; SMN2 | |
| SCHEMBL631024 | 0.78 | AKR1C3 (0.65) | LMNAMCOLN3ADRB1AKR1C3AR | |
| SCHEMBL173027 | 0.78 | ADRB1 (0.62) | LMNAMCOLN3ADRB1AKR1C3ALDH1A1 |
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-4469694-A | 2-(1-Piperazinyl)-2,4,6-cycloheptatrien-1-one derivatives | AYERST, MCKENNA & HARRISON INC. (CA) | 1984-09-04 | — | — | US | claimed |