Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 7/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24314303 | 0.94 | MEN1 (0.35) | ALDH1A1MAPTMEN1KMT2ANPSR1 | |
| SCHEMBL24314223 | 0.92 | PDE4A (0.34) | PDK2KCNH2MCHR1ACACB | |
| SCHEMBL24313680 | 0.91 | KCNH2 (0.39) | ALDH1A1SMN1; SMN2NPSR1KCNH2MCHR1 | |
| SCHEMBL24314317 | 0.91 | PDK2 (0.37) | PDK2HTR1ASLC6A4 | |
| SCHEMBL24314235 | 0.90 | KCNH2 (0.36) | ALDH1A1MAPTMEN1KMT2AKCNH2 | |
| SCHEMBL24314313 | 0.90 | ACACB (0.36) | ACACB | |
| SCHEMBL24314217 | 0.88 | PDE4D (0.31) | — | |
| SCHEMBL24313754 | 0.88 | MEN1 (0.36) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL24313761 | 0.87 | MEN1 (0.32) | ALDH1A1MAPTMEN1KMT2ANPSR1 | |
| SCHEMBL24313977 | 0.87 | CYP1A2 (0.37) | ALDH1A1MEN1KMT2AKCNH2MCHR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022081842-A1 | SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER | THE BROAD INSTITUTE, INC. (US) | 2022-04-21 | — | — | WO | disclosed |