Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 4/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 4/20 | 0.38 |
| ▸ | KDR | P35968 | 3/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 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 | |
|---|---|---|---|---|
| SCHEMBL24254518 | 0.84 | ALDH1A1 (0.49) | ALDH1A1RECQLCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9973781 | 0.80 | ALDH1A1 (0.56) | ALDH1A1RECQLCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL17681593 | 0.80 | ALDH1A1 (0.56) | ALDH1A1RECQLCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9973787 | 0.78 | ALDH1A1 (0.55) | ALDH1A1RECQLCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL17681780 | 0.78 | CYP1A2 (0.70) | ALDH1A1RECQLCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1527189 | 0.78 | ALDH1A1 (0.55) | ALDH1A1RECQLCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL19459414 | 0.77 | MAPT (0.54) | ALDH1A1RECQLCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL24254516 | 0.77 | KMT2A (0.51) | ALDH1A1RECQLCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL19459433 | 0.76 | ALDH1A1 (0.58) | ALDH1A1RECQLCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL5962103 | 0.74 | POLB (0.56) | ALDH1A1RECQLEPHX2L3MBTL1POLB |
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-2022035804-A1 | SUBSTITUTED 3-AMINO-4-METHYLBENZENESULFONAMIDES AS SMALL MOLECULE INHIBITORS OF UBIQUITIN-SPECIFIC PROTEASE 28 | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2022-02-17 | — | — | WO | disclosed |