Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 7/20 | 0.46 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | KDM4A | O75164 | 1/20 | 0.41 |
| ▸ | KDM4B | O94953 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL20783115 | 0.86 | ALDH1A1 (0.59) | ALDH1A1CYP3A4MAPTVCAM1MEN1 | |
| SCHEMBL537580 | 0.83 | VCAM1 (0.55) | ALDH1A1CYP3A4MAPTVCAM1MEN1 | |
| SCHEMBL30458055 | 0.81 | ALDH1A1 (0.60) | ALDH1A1CYP3A4MAPTMEN1KMT2A | |
| SCHEMBL1193334 | 0.81 | ALDH1A1 (0.60) | ALDH1A1CYP3A4MAPTMEN1KMT2A | |
| SCHEMBL838256 | 0.81 | ALDH1A1 (0.71) | ALDH1A1CYP3A4MAPTVCAM1MEN1 | |
| SCHEMBL9789906 | 0.79 | VCAM1 (0.55) | ALDH1A1CYP3A4MAPTVCAM1MEN1 | |
| SCHEMBL4090172 | 0.79 | ALDH1A1 (0.58) | ALDH1A1CYP3A4MAPTMEN1KMT2A | |
| SCHEMBL30606309 | 0.79 | ALDH1A1 (0.58) | ALDH1A1CYP3A4MAPTMEN1KMT2A | |
| SCHEMBL4647602 | 0.79 | VCAM1 (0.46) | ALDH1A1CYP3A4MAPTVCAM1TDP1 | |
| SCHEMBL11046388 | 0.79 | VCAM1 (0.46) | ALDH1A1CYP3A4MAPTVCAM1TDP1 |
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 |