Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 4/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9684886 | 1.00 | ALDH1A1 (0.47) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9684099 | 0.83 | ABCB1 (0.42) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9684091 | 0.83 | ABCB1 (0.42) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9787435 | 0.80 | ABCB1 (0.46) | CYP2D6POLBGAAABCB1LMNA | |
| SCHEMBL9787439 | 0.80 | ABCB1 (0.46) | CYP2D6POLBGAAABCB1LMNA | |
| SCHEMBL10822432 | 0.80 | KDM4E (0.44) | ALDH1A1MEN1KMT2A | |
| SCHEMBL10822435 | 0.80 | KDM4E (0.44) | ALDH1A1MEN1KMT2A | |
| SCHEMBL10822438 | 0.80 | KDM4E (0.44) | ALDH1A1MEN1KMT2A | |
| SCHEMBL9685069 | 0.80 | ADRB1 (0.54) | CYP1A2MEN1KMT2A | |
| SCHEMBL9685064 | 0.80 | ADRB1 (0.54) | CYP1A2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5166218-A | Antilipemic agents or antiglycemic agents | HOFFMANN-LA ROCHE INC. (US) | 1992-11-24 | — | — | US | disclosed |
| US-5064863-A | Catabolic activity, obesity, diabetes | HOFFMANN-LA ROCHE INC. (US) | 1991-11-12 | — | — | US | disclosed |