Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | MMP2 | P08253 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3996792 | 1.00 | TP53 (0.47) | TP53ALDH1A1NPSR1THRBSLC6A3 | |
| SCHEMBL14045008 | 0.98 | THRB (0.46) | TP53ALDH1A1NPSR1THRBSLC6A3 | |
| SCHEMBL26999462 | 0.98 | THRB (0.46) | TP53ALDH1A1NPSR1THRBSLC6A3 | |
| SCHEMBL28755738 | 0.93 | THRB (0.46) | TP53ALDH1A1NPSR1THRBSLC6A3 | |
| SCHEMBL1485389 | 0.89 | — | — | |
| SCHEMBL9846853 | 0.80 | EPHX1 (0.52) | TP53ALDH1A1NPSR1THRBSLC6A3 | |
| SCHEMBL19941727 | 0.80 | TP53 (0.62) | TP53ALDH1A1NPSR1THRBSLC6A3 | |
| SCHEMBL3538057 | 0.80 | EPHX1 (0.52) | TP53ALDH1A1NPSR1THRBSLC6A3 | |
| SCHEMBL27737037 | 0.80 | TP53 (0.49) | TP53ALDH1A1NPSR1THRBSLC6A3 | |
| SCHEMBL19942011 | 0.80 | TP53 (0.62) | TP53ALDH1A1NPSR1THRBSLC6A3 |
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-1169338-B1 | LOW-MOLECULAR INHIBITORS OF COMPLEMENT PROTEASES | ABBOTT GMBH & CO KG (DE) | 2004-11-03 | — | — | EP | disclosed |
| US-6683055-B1 | GUANIDINE OR AMIDINE TERMINED PEPTIDES | BASF AKTIENGESELLSCHAFT (DE) | 2004-01-27 | — | — | US | disclosed |