Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL7423100 | 0.75 | LMNA (0.37) | ALDH1A1LMNA | |
| SCHEMBL82497 | 0.73 | TSHR (0.33) | ALDH1A1TDP1TSHRLMNA | |
| SCHEMBL19641937 | 0.73 | ALOX5 (0.39) | LMNA | |
| SCHEMBL3910041 | 0.72 | — | — | |
| SCHEMBL3911224 | 0.72 | — | — | |
| SCHEMBL197640 | 0.72 | — | — | |
| Acetone SCHEMBL28230335 | 0.71 | LMNA (0.40) | ALDH1A1TDP1TSHRCA4LMNA | |
| Hydrochloric Acid SCHEMBL6491086 | 0.71 | ALDH1A1 (0.32) | ALDH1A1TDP1TSHRLMNA | |
| SCHEMBL624169 | 0.71 | TP53 (0.37) | ALDH1A1TDP1TSHRLMNA | |
| SCHEMBL9305389 | 0.71 | ALDH1A1 (0.32) | ALDH1A1TDP1TSHRLMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6281365-B1 | ANTITUMOR AGENTS | AMERICAN CYANAMID COMPANY | 2001-08-28 | — | — | US | disclosed |
| US-4880790-A | ANTICANCER, ANTITUMOR AGENTS | AMERICAN CYANAMID COMPANY (US) | 1989-11-14 | — | — | US | disclosed |
| EP-0232784-A2 | (Gem-heterocyclodimethanamine-N,N')platinum complexes | AMERICAN CYANAMID COMPANY (US) | 1987-08-19 | — | — | EP | disclosed |