Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | FBP1 | P09467 | 1/20 | 0.49 |
| ▸ | VCP | P55072 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8669802 | 0.92 | TSHR (0.57) | NFE2L2TSHRMEN1KMT2ACYP1A2 | |
| SCHEMBL12470562 | 0.85 | ALDH1A1 (0.58) | NFE2L2TSHRMEN1KMT2ACYP1A2 | |
| SCHEMBL8425628 | 0.81 | CYP1A2 (0.53) | MEN1KMT2ACYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL5552353 | 0.81 | CYP1A2 (0.53) | NFE2L2TSHRMEN1KMT2ACYP1A2 | |
| SCHEMBL287236 | 0.81 | TSHR (0.65) | NFE2L2TSHRMEN1KMT2ACYP1A2 | |
| SCHEMBL6376999 | 0.81 | CYP19A1 (0.61) | NFE2L2TSHRMEN1KMT2AALDH1A1 | |
| SCHEMBL3718150 | 0.80 | TSHR (0.62) | NFE2L2TSHRMEN1KMT2ACYP1A2 | |
| SCHEMBL11114204 | 0.78 | NFE2L2 (0.69) | NFE2L2MEN1KMT2ACYP1A2CYP2D6 | |
| SCHEMBL11114201 | 0.78 | NFE2L2 (0.69) | NFE2L2MEN1KMT2ACYP1A2CYP2D6 | |
| SCHEMBL7077091 | 0.78 | TSHR (0.61) | NFE2L2TSHRMEN1KMT2ACYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |