Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.59 |
| ▸ | TSHR | P16473 | 3/20 | 0.59 |
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | BLM | P54132 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | TTR | P02766 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9099854 | 1.00 | ALDH1A1 (0.59) | ALDH1A1TDP1TSHRHPGDCYP3A4 | |
| SCHEMBL29952407 | 0.86 | IDO1 (0.46) | ALDH1A1TDP1TSHRHPGDCYP3A4 | |
| SCHEMBL2647457 | 0.86 | IDO1 (0.46) | ALDH1A1TDP1TSHRHPGDCYP3A4 | |
| SCHEMBL4245330 | 0.85 | MEN1 (0.61) | ALDH1A1TDP1TSHRHPGDMEN1 | |
| Hydrochloric Acid SCHEMBL17509631 | 0.84 | IDO1 (0.45) | ALDH1A1TDP1TSHRHPGDCYP3A4 | |
| SCHEMBL15453223 | 0.79 | MEN1 (0.39) | ALDH1A1TDP1TSHRHPGDCYP3A4 | |
| SCHEMBL5748981 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TDP1TSHRHPGDCYP3A4 | |
| SCHEMBL2459975 | 0.78 | MEN1 (0.46) | ALDH1A1TDP1TSHRHPGDCYP3A4 | |
| SCHEMBL9031082 | 0.78 | ALDH1A1 (0.48) | ALDH1A1TDP1TSHRHPGDCYP3A4 | |
| SCHEMBL5746410 | 0.78 | ALDH1A1 (0.42) | ALDH1A1TDP1TSHRHPGDCYP3A4 |
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 |