Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TSPO | P30536 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.46 |
| ▸ | TTR | P02766 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL571709 | 0.91 | CTNNB1 (0.55) | CTNNB1L3MBTL1LMNAALDH1A1TSHR | |
| Butane SCHEMBL1395551 | 0.89 | KDM4E (0.47) | L3MBTL1POLBLMNAALDH1A1TSHR | |
| SCHEMBL16319105 | 0.83 | CTNNB1 (0.47) | CTNNB1L3MBTL1LMNAMAPTALDH1A1 | |
| SCHEMBL1345670 | 0.82 | ELANE (0.51) | CTNNB1L3MBTL1POLBATMNPSR1 | |
| SCHEMBL16319433 | 0.80 | HTT (0.48) | CTNNB1LMNAMAPTALDH1A1TSHR | |
| Butane SCHEMBL1960365 | 0.79 | KDM4E (0.44) | L3MBTL1POLBLMNAMAPTALDH1A1 | |
| SCHEMBL6690457 | 0.79 | KDM4E (0.58) | CTNNB1L3MBTL1POLBLMNAMAPT | |
| SCHEMBL11881421 | 0.79 | CTNNB1 (0.55) | CTNNB1L3MBTL1LMNAALDH1A1TSHR | |
| SCHEMBL4619100 | 0.79 | KMT2A (0.46) | CTNNB1POLBLMNAALDH1A1KMT2A | |
| SCHEMBL27614522 | 0.79 | CTNNB1 (0.61) | CTNNB1L3MBTL1ATMNPSR1LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6867200-B1 | (Hetero)aryl-bicyclic heteroaryl derivatives, their preparation and their use as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2005-03-15 | — | — | US | disclosed |
| EP-1140859-A2 | (HETERO)ARYL-BICYCLIC HETEROARYL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000035886-A2 | (HETERO)ARYL-BICYCLIC HETEROARYL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2000-06-22 | — | — | WO | disclosed |