Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | TDO2 | P48775 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1766092 | 1.00 | ALDH1A1 (0.40) | ALDH1A1MAPTTDP1KDM4EMEN1 | |
| SCHEMBL27768928 | 0.83 | VCAM1 (0.40) | ALDH1A1MAPTTDP1KDM4EMEN1 | |
| SCHEMBL29719028 | 0.83 | EGFR (0.41) | ALDH1A1MAPTTDP1KDM4EMEN1 | |
| SCHEMBL25409 | 0.83 | EGFR (0.41) | ALDH1A1MAPTTDP1KDM4EMEN1 | |
| SCHEMBL156334 | 0.81 | MAP4K4 (0.43) | ALDH1A1MAPTTDP1VCAM1ATM | |
| Hydrochloric Acid SCHEMBL4781507 | 0.81 | EGFR (0.40) | ALDH1A1MAPTTDP1KDM4EMEN1 | |
| SCHEMBL17538470 | 0.81 | MAPT (0.40) | ALDH1A1MAPTTDP1KDM4EMEN1 | |
| SCHEMBL30420453 | 0.81 | MAP4K4 (0.43) | ALDH1A1MAPTTDP1VCAM1ATM | |
| SCHEMBL22983920 | 0.81 | ABCG2 (0.38) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| SCHEMBL16212173 | 0.81 | EGFR (0.40) | ALDH1A1MAPTTDP1MEN1KMT2A |
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-2022170052-A1 | QUINAZOLINE DERIVATIVES, PYRIDOPYRIMIDINE DERIVATIVES, PYRIMIDOPYRIMIDINE DERIVATIVES, AND USES THEREOF | BLACK DIAMOND THERAPEUTICS, INC. (US) | 2022-08-11 | — | — | WO | disclosed |