Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | BCL2 | P10415 | 1/20 | 0.38 |
| ▸ | GPR183 | P32249 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.36 |
| ▸ | MDM4 | O15151 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28080836 | 0.92 | F2RL3 (0.39) | ALDH1A1LMNAADRA1D | |
| SCHEMBL28080828 | 0.88 | CCR2 (0.46) | MEN1KMT2AHTTESR1 | |
| SCHEMBL28080894 | 0.88 | ALDH1A1 (0.47) | ALDH1A1KDM4ELMNAHTTSMN1; SMN2 | |
| SCHEMBL28080843 | 0.85 | CYP11B1 (0.44) | ALDH1A1KDM4EPOLBLMNACYP11B1 | |
| SCHEMBL28080966 | 0.85 | GFER (0.46) | ALDH1A1POLBLMNACYP11B1CYP11B2 | |
| SCHEMBL28080891 | 0.84 | ALDH1A1 (0.44) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL28831826 | 0.81 | AR (0.41) | ALDH1A1KDM4EPOLBLMNAMEN1 | |
| SCHEMBL27962502 | 0.78 | HDAC4 (0.37) | — | |
| SCHEMBL27638475 | 0.77 | HDAC8 (0.38) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL28080840 | 0.77 | COMT (0.41) | SMN1; SMN2ADRA1D |
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 |
|---|---|---|---|---|---|---|---|
| CN-103804108-B | A kind of method preparing primary amine | 沈阳药科大学 | 2016-08-03 | — | — | CN | disclosed |