Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.31 |
| ▸ | GRIA1 | P42261 | 3/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | XBP1 | P17861 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14829803 | 0.89 | TSHR (0.39) | GRIA1LMNAMEN1XBP1KMT2A | |
| SCHEMBL23806554 | 0.89 | TSHR (0.46) | SIGMAR1LMNAMEN1XBP1KMT2A | |
| SCHEMBL21105798 | 0.87 | EPHX1 (0.46) | SIGMAR1LMNAMEN1XBP1KMT2A | |
| SCHEMBL15987213 | 0.87 | EPHX1 (0.46) | SIGMAR1LMNAMEN1XBP1KMT2A | |
| SCHEMBL21800021 | 0.87 | CA12 (0.42) | LMNAMEN1KMT2ACYP1A2CYP2C9 | |
| SCHEMBL22374575 | 0.87 | EPHX1 (0.46) | SIGMAR1LMNAMEN1XBP1KMT2A | |
| SCHEMBL11922822 | 0.85 | TSHR (0.39) | SIGMAR1LMNAMEN1XBP1KMT2A | |
| SCHEMBL24672378 | 0.84 | LMNA (0.40) | LMNA | |
| SCHEMBL23806654 | 0.84 | LMNA (0.40) | LMNA | |
| SCHEMBL21799933 | 0.84 | CA12 (0.40) | LMNAMEN1KMT2AALDH1A1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008130721-A1 | PREPARATION OF SECONDARY DIAMINES | ALBEMARLE CORPORATION (US) | 2008-10-30 | — | — | WO | disclosed |