Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 7/20 | 0.54 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.51 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.50 |
| ▸ | CHRNA5 | P30532 | 4/20 | 0.50 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 6/20 | 0.49 |
| ▸ | RAB9A | P51151 | 6/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.49 |
| ▸ | MAPT | P10636 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1423258 | 0.81 | CHRNB2 (0.61) | TP53S1PR1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL10316671 | 0.78 | ALDH1A1 (0.57) | TP53S1PR1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL27767567 | 0.76 | S1PR1 (0.52) | TP53S1PR1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL1423075 | 0.76 | S1PR1 (0.52) | TP53S1PR1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL3715047 | 0.76 | CHRNB2 (0.62) | TP53S1PR1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL1422372 | 0.75 | KMO (0.67) | TP53S1PR1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL2273541 | 0.75 | CHRNB2 (0.66) | TP53S1PR1CHRNB2CHRNA5CHRNA4 | |
| Hydrochloric Acid SCHEMBL2278057 | 0.74 | CHRNB2 (0.64) | TP53S1PR1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL1422479 | 0.74 | CHRNB2 (0.64) | TP53S1PR1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL28784577 | 0.74 | S1PR1 (0.62) | TP53S1PR1CHRNB2CHRNA5CHRNA4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2226074-A2 | Pharmaceutical compositions and their methods of use | Abbott Laboratories (US) | 2010-09-08 | — | — | EP | claimed |
| EP-2226074-A2 | Pharmaceutical compositions and their methods of use | Abbott Laboratories (US) | 2010-09-08 | — | — | EP | disclosed |