Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | FPR2 | P25090 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15332731 | 1.00 | CA2 (0.47) | CA2CA1ALDH1A1KDM4EGAA | |
| SCHEMBL15332560 | 0.86 | SMYD3 (0.47) | CA2CA1ALDH1A1KDM4EGAA | |
| SCHEMBL15330035 | 0.77 | GRN (0.48) | CA2CA1ALDH1A1KDM4EGAA | |
| SCHEMBL29955250 | 0.77 | SMYD3 (0.47) | ALDH1A1KDM4EGAASMYD3BRD4 | |
| SCHEMBL2556744 | 0.75 | GRN (0.52) | ALDH1A1KDM4EGAASMYD3BRD4 | |
| SCHEMBL15332548 | 0.74 | SMYD3 (0.46) | CA2ALDH1A1KDM4EGAASMYD3 | |
| SCHEMBL3433136 | 0.72 | GPR84 (0.49) | CA2CA1ALDH1A1L3MBTL1FPR2 | |
| SCHEMBL2377934 | 0.71 | CA2 (0.68) | CA2CA1ALDH1A1FPR2MEN1 | |
| SCHEMBL10664012 | 0.71 | CA2 (0.68) | CA2CA1ALDH1A1FPR2MEN1 | |
| SCHEMBL22687175 | 0.71 | CA2 (0.68) | CA2CA1ALDH1A1FPR2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |