Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 2/20 | 0.50 |
| ▸ | MAOB | P27338 | 7/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.43 |
| ▸ | P4HB | P07237 | 1/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | CCNC | P24863 | 1/20 | 0.39 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.39 |
| ▸ | JUN | P05412 | 1/20 | 0.39 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.39 |
| ▸ | TFEB | P19484 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22026727 | 0.85 | NFKB1 (0.68) | NFKB1MAOBP4HBABCG2LMNA | |
| SCHEMBL818741 | 0.84 | NFKB1 (0.56) | NFKB1MAOBP4HBABCG2MAPT | |
| SCHEMBL8402490 | 0.84 | NFKB1 (0.56) | NFKB1MAOBP4HBABCG2MAPT | |
| SCHEMBL5432216 | 0.82 | NFKB1 (0.44) | NFKB1MAOBP4HBABCG2LMNA | |
| SCHEMBL6510369 | 0.82 | NFKB1 (0.74) | NFKB1MAOBP4HBABCG2LMNA | |
| SCHEMBL29462703 | 0.82 | NFKB1 (0.74) | NFKB1MAOBP4HBABCG2LMNA | |
| SCHEMBL9788936 | 0.82 | NFKB1 (0.50) | NFKB1MAOBP4HBABCG2LMNA | |
| SCHEMBL2328371 | 0.80 | NFKB1 (0.50) | NFKB1PTPN1LMNAMAPTCCNC | |
| SCHEMBL5432209 | 0.80 | MAOB (0.45) | NFKB1MAOBLMNAMEN1KMT2A | |
| SCHEMBL30071985 | 0.80 | MAOB (0.45) | NFKB1MAOBLMNAMEN1KMT2A |
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-1998042657-A1 | SYNTHESIS OF α,β-SUBSTITUTED AMINO AMIDES, ESTERS AND ACIDS | THE SCRIPPS RESEARCH INSTITUTE (US) | 1998-10-01 | — | — | WO | disclosed |