Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | EBP | Q15125 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9429181 | 0.81 | SIGMAR1 (0.46) | ADRA2AADRA2BADRA2CADRA1DHTR1D | |
| SCHEMBL9428929 | 0.81 | SIGMAR1 (0.46) | ADRA2AADRA2BADRA2CADRA1DHTR1D | |
| SCHEMBL9455456 | 0.76 | LTA4H (0.39) | — | |
| SCHEMBL11061808 | 0.72 | CYP2A6 (0.41) | ALDH1A1TP53TSHR | |
| SCHEMBL23933926 | 0.71 | HRH3 (0.42) | TP53TSHRSLC6A4 | |
| SCHEMBL16552443 | 0.71 | TSHR (0.37) | ALDH1A1TP53TSHR | |
| SCHEMBL12747106 | 0.71 | TP53 (0.36) | ALDH1A1TP53TSHR | |
| SCHEMBL24507698 | 0.71 | TP53 (0.36) | ALDH1A1TP53TSHR | |
| SCHEMBL24939006 | 0.70 | ALDH1A1 (0.45) | ALDH1A1SIGMAR1TP53TSHR | |
| SCHEMBL4918208 | 0.70 | IDO1 (0.42) | ALDH1A1 |
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-5242948-A | BISGUANIDINES AND FUNGICIDES CONTAINING THEM | BASF AKTIENGESELLSCHAFT (DE) | 1993-09-07 | — | — | US | disclosed |