Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | MMP12 | P39900 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31583473 | 0.76 | — | — | |
| SCHEMBL208469 | 0.76 | GRIA1 (0.37) | DHFRTSHRSMN1; SMN2TDP1PKM | |
| SCHEMBL26337917 | 0.75 | ALDH1A1 (0.44) | SMN1; SMN2CA2 | |
| SCHEMBL28781877 | 0.74 | DHFR (0.33) | DHFRTSHRSMN1; SMN2TDP1PKM | |
| SCHEMBL9609222 | 0.73 | ALDH1A1 (0.33) | CA2 | |
| SCHEMBL26734037 | 0.70 | ALDH1A1 (0.49) | TSHRSMN1; SMN2TDP1KDM4ECA2 | |
| SCHEMBL802549 | 0.69 | CA12 (0.49) | TDP1CA2 | |
| SCHEMBL25684910 | 0.69 | SMN1; SMN2 (0.41) | SMN1; SMN2 | |
| SCHEMBL3310419 | 0.67 | CA2 (0.41) | DHFRTSHRSMN1; SMN2TDP1POLB | |
| SCHEMBL8876950 | 0.67 | — | — |
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-2023118576-A1 | DHODH INHIBITORS CONTAINING A CARBOXYLIC ACID BIOISOSTERE | IMMUNIC AG (DE) | 2023-06-29 | — | — | WO | disclosed |