Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CTSD | P07339 | 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 | |
|---|---|---|---|---|
| SCHEMBL9330870 | 0.72 | HCAR2 (0.43) | MAPTCYP1A2ALDH1A1POLBCYP2C9 | |
| SCHEMBL9845672 | 0.72 | HCAR2 (0.43) | MAPTCYP1A2ALDH1A1POLBCYP2C9 | |
| SCHEMBL9845559 | 0.72 | HCAR2 (0.43) | MAPTCYP1A2ALDH1A1POLBCYP2C9 | |
| SCHEMBL2461936 | 0.72 | HSD17B10 (0.50) | CYP1A2ALDH1A1MEN1KMT2ANPC1 | |
| Crotonic Acid SCHEMBL27807284 | 0.71 | MAPT (0.62) | MAPTMAOBCYP1A2ALDH1A1POLB | |
| Crotonic Acid SCHEMBL27983318 | 0.71 | MAPT (0.62) | MAPTMAOBCYP1A2ALDH1A1POLB | |
| SCHEMBL42323 | 0.70 | MAPT (1.00) | MAPTMAOBALDH1A1MEN1KMT2A | |
| SCHEMBL10673342 | 0.70 | MAPT (1.00) | MAPTMAOBALDH1A1MEN1KMT2A | |
| SCHEMBL820084 | 0.70 | MAPT (1.00) | MAPTMAOBALDH1A1MEN1KMT2A | |
| SCHEMBL3295983 | 0.70 | MAPT (1.00) | MAPTMAOBALDH1A1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3411361-B1 | NRF2 ACTIVATING COMPOUNDS AND USES THEREOF | RIGEL PHARMACEUTICALS INC (US) | 2020-11-25 | — | — | EP | disclosed |