Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | CMA1 | P23946 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | FBP1 | P09467 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8740108 | 1.00 | NR1I2 (0.44) | NR1I2ALDH1A1TSHRAKR1C3ABCG2 | |
| SCHEMBL21879712 | 0.66 | ALDH1A1 (0.55) | NR1I2ALDH1A1TSHRAKR1C3ABCG2 | |
| SCHEMBL728134 | 0.66 | ALDH1A1 (0.55) | NR1I2ALDH1A1TSHRAKR1C3ABCG2 | |
| SCHEMBL8744885 | 0.65 | ALDH1A1 (0.44) | ALDH1A1TSHRAKR1C3MEN1KMT2A | |
| Benzaldehyde SCHEMBL27706768 | 0.65 | ALDH1A1 (0.56) | NR1I2ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL15052966 | 0.65 | AKR1C3 (0.48) | ALDH1A1TSHRAKR1C3MEN1KMT2A | |
| SCHEMBL14130850 | 0.65 | AKR1C3 (0.48) | ALDH1A1TSHRAKR1C3MEN1KMT2A | |
| SCHEMBL15969887 | 0.65 | AKR1C3 (0.48) | ALDH1A1TSHRAKR1C3MEN1KMT2A | |
| SCHEMBL8842901 | 0.65 | POLB (0.32) | ALDH1A1KMT2APOLBMAPTSMN1; SMN2 | |
| SCHEMBL57086 | 0.64 | ALDH1A1 (0.46) | NR1I2ALDH1A1TSHRAKR1C3ABCG2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5703263-A | USEFUL AS ANTIBIOTICS AND/OR AS INTERMEDIATES IN THE PREPARATION OF PHOSPHORUS-CONTAINING ANALOGS OF PEPTIDES | MONSANTO COMPANY (US) | 1997-12-30 | — | — | US | disclosed |
| US-5654462-A | CATALYTIC HYDROGENATION OF OLEFINS; ANTIBIOTICS; ENZYME INHIBITOR | MONSANTO COMPANY (US) | 1997-08-05 | — | — | US | disclosed |