Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | WNT3A | P56704 | 1/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.43 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.43 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21770403 | 0.89 | PLAU (0.56) | ALDH1A1LMNANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL24891987 | 0.85 | ALDH1A1 (0.50) | ALDH1A1LMNANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL23291297 | 0.80 | GAA (0.69) | ALDH1A1LMNAPKMMEN1KMT2A | |
| SCHEMBL22441340 | 0.79 | MEN1 (0.59) | ALDH1A1LMNANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15727556 | 0.79 | LMNA (0.67) | ALDH1A1LMNANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL12725161 | 0.78 | KMT2A (0.69) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| Trifluoroacetic Acid SCHEMBL30182473 | 0.78 | KDM4E (0.48) | ALDH1A1LMNANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL24891741 | 0.78 | MEN1 (0.63) | LMNANPC1RAB9ASMN1; SMN2PKM | |
| SCHEMBL1760232 | 0.77 | — | — | |
| SCHEMBL1760234 | 0.77 | — | — |
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-2023287736-A1 | NOVEL BIS-AMIDE CONTAINING COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2023-01-19 | — | — | WO | disclosed |