Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.39 |
| ▸ | PBRM1 | Q86U86 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9648703 | 0.81 | ALOX5 (0.44) | RAB9ANPC1TSHRSMN1; SMN2NOTUM | |
| SCHEMBL101757 | 0.81 | ACHE (0.41) | ACHEL3MBTL1RAB9ANPC1HPGD | |
| SCHEMBL5899212 | 0.79 | HPGD (0.35) | AKR1C2AKR1C1ACHEL3MBTL1RAB9A | |
| SCHEMBL17444071 | 0.79 | ACHE (0.41) | AKR1C2ACHERAB9ANPC1HPGD | |
| SCHEMBL9769410 | 0.79 | HSD17B1 (0.45) | TSHRSMN1; SMN2ALDH1A1MAPTTP53 | |
| SCHEMBL2013348 | 0.79 | TAAR1 (0.39) | NOTUMMEN1ALDH1A1KMT2AIDO1 | |
| SCHEMBL16720373 | 0.79 | ACHE (0.41) | AKR1C2AKR1C1ACHEL3MBTL1RAB9A | |
| SCHEMBL9430884 | 0.78 | DYRK1A (0.44) | ACHERAB9ASMN1; SMN2NOTUMCNR1 | |
| SCHEMBL4790399 | 0.77 | CYP2A6 (0.44) | L3MBTL1RAB9ANPC1HPGDTSHR | |
| SCHEMBL8093284 | 0.76 | HPGD (0.43) | ACHERAB9ANPC1HPGDTSHR |
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-1315718-A1 | BICYCLIC HETEROCYCLES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE, AND METHODS FOR THE PRODUCTION THEREOF | Boehringer Ingelheim Pharma GmbH & Co.KG (DE) | 2003-06-04 | — | — | EP | claimed |
| WO-2002018372-A1 | BICYCLIC HETEROCYCLES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE, AND METHODS FOR THE PRODUCTION THEREOF | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2002-03-07 | — | — | WO | claimed |