Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.53 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.50 |
| ▸ | HNF4A | P41235 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.47 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.47 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | FABP3 | P05413 | 1/20 | 0.42 |
| ▸ | FABP4 | P15090 | 1/20 | 0.42 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7864455 | 0.96 | BCAT2 (0.59) | BCAT2GPR52HNF4AMEN1KMT2A | |
| SCHEMBL11528273 | 0.84 | HNF4A (0.49) | BCAT2GPR52HNF4AMEN1KMT2A | |
| Water SCHEMBL11409301 | 0.83 | HNF4A (0.47) | BCAT2GPR52HNF4AMEN1KMT2A | |
| Water SCHEMBL11415614 | 0.83 | HNF4A (0.47) | BCAT2GPR52HNF4AMEN1KMT2A | |
| SCHEMBL3627480 | 0.83 | PDCD1 (0.47) | BCAT2GPR52HNF4AMEN1KMT2A | |
| SCHEMBL11530033 | 0.83 | BCAT2 (0.46) | BCAT2GPR52HNF4AMEN1KMT2A | |
| SCHEMBL11525121 | 0.81 | BRS3 (0.46) | BCAT2GPR52SMN1; SMN2ALDH1A1HTT | |
| SCHEMBL420969 | 0.79 | ALDH1A1 (0.59) | SMN1; SMN2ALDH1A1MAPK1TDP1TSHR | |
| SCHEMBL10951356 | 0.78 | ALDH1A1 (0.47) | HNF4AMEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL5180034 | 0.78 | BCAT2 (0.57) | BCAT2GPR52HNF4AMEN1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101142226-A | Tricyclic-nucleoside prodrugs for treating viral infections | GENELABS TECH INC (US) | 2008-03-12 | — | — | CN | claimed |
| CN-102592040-B | The method of drug discovery | 基德姆生物科学有限公司 | 2016-12-21 | — | — | CN | disclosed |
| CN-101142226-A | Tricyclic-nucleoside prodrugs for treating viral infections | GENELABS TECH INC (US) | 2008-03-12 | — | — | CN | disclosed |
| CN-1668918-A | Methods of Drug Discovery | KEDDEM BIO SCIENCE LTD (IL) | 2005-09-14 | — | — | CN | disclosed |