Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | ANPEP | P15144 | 1/20 | 0.42 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 5/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6887458 | 0.91 | SIGMAR1 (0.51) | SIGMAR1KCNH2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL6890175 | 0.90 | CYP1A2 (0.48) | OPRK1POLBLMNACYP2D6TAAR1 | |
| SCHEMBL7636221 | 0.90 | POLB (0.50) | OPRK1POLBCYP2D6TAAR1ALDH1A1 | |
| SCHEMBL6891363 | 0.88 | KMT2A (0.55) | SIGMAR1ANPEPERAP2ADRB2ATM | |
| SCHEMBL6893114 | 0.86 | SIGMAR1 (0.42) | SIGMAR1OPRK1KCNH2ANPEPERAP2 | |
| SCHEMBL6895745 | 0.84 | LMNA (0.47) | SIGMAR1POLBLMNACYP2D6ALDH1A1 | |
| SCHEMBL9583506 | 0.84 | SIGMAR1 (0.54) | SIGMAR1OPRK1KCNH2ADRB2POLB | |
| SCHEMBL6894568 | 0.83 | CYP3A4 (0.44) | OPRK1KCNH2ANPEPADRB2LMNA | |
| Hydrochloric Acid SCHEMBL9583840 | 0.83 | SIGMAR1 (0.53) | SIGMAR1OPRK1KCNH2POLBLMNA | |
| SCHEMBL6895074 | 0.81 | HPGD (0.44) | ANPEPLMNAALDH1A1ADRA2AAOC3 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2004502669-A | — | — | 2004-01-29 | — | — | JP | claimed |
| EP-1353898-A2 | COMPOUNDS TO TREAT ALZHEIMER'S DISEASE | Elan Pharmaceuticals, Inc. (US) | 2003-10-22 | — | — | EP | claimed |
| WO-2002002512-A2 | COMPOUNDS TO TREAT ALZHEIMER'S DISEASE | ELAN PHARMACEUTICALS, INC. (US) | 2002-01-10 | — | — | WO | claimed |