Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 9/20 | 0.42 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 9/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.41 |
| ▸ | POLB | P06746 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | STK17B | O94768 | 1/20 | 0.40 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 7/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL19983291 | 0.86 | TDP1 (0.41) | TDP1ATMNPSR1KMT2APOLB | |
| SCHEMBL21153178 | 0.84 | CYP3A4 (0.49) | TDP1ATMNPSR1KMT2APOLB | |
| SCHEMBL23023429 | 0.83 | TDP1 (0.43) | TDP1ATMNPSR1KMT2APOLB | |
| SCHEMBL19983324 | 0.82 | FOLH1 (0.50) | TDP1ATMNPSR1KMT2APOLB | |
| SCHEMBL21153286 | 0.82 | CA1 (0.43) | TDP1ATMNPSR1KMT2APOLB | |
| SCHEMBL21152481 | 0.82 | FOLH1 (0.50) | TDP1ATMNPSR1KMT2APOLB | |
| SCHEMBL21153435 | 0.80 | TDP1 (0.41) | TDP1ATMNPSR1KMT2APOLB | |
| SCHEMBL19982962 | 0.78 | CA1 (0.40) | TDP1NPSR1KMT2APOLBMEN1 | |
| SCHEMBL21153176 | 0.77 | FOLH1 (0.46) | TDP1ATMNPSR1KMT2APOLB | |
| SCHEMBL21152634 | 0.74 | FOLH1 (0.51) | TDP1ATMNPSR1KMT2APOLB |
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-2018053353-A1 | KETONE INHIBITORS OF LYSINE GINGIPAIN | Cortexyme, Inc. (US) | 2018-03-22 | — | — | WO | disclosed |