Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL65000 | 0.92 | CYP1A2 (0.53) | MAPK1CYP1A2CA12CA1CA2 | |
| Fluoride SCHEMBL1056432 | 0.88 | CYP1A2 (0.50) | MAPK1CYP1A2CA12CA1CA2 | |
| Hydrochloric Acid SCHEMBL2139422 | 0.88 | CYP1A2 (0.50) | MAPK1CYP1A2CA12CA1CA2 | |
| Ammonia Solution, Strong SCHEMBL5964780 | 0.88 | CYP1A2 (0.50) | MAPK1CYP1A2CA12CA1CA2 | |
| SCHEMBL8021435 | 0.88 | CYP1A2 (0.50) | MAPK1CYP1A2CA12CA1CA2 | |
| SCHEMBL5669823 | 0.83 | MAPK1 (0.42) | MAPK1CYP1A2CA12CA1CA2 | |
| SCHEMBL6969086 | 0.79 | CYP1A2 (0.43) | MAPK1CYP1A2CA12CA1CA2 | |
| Diaminooctane SCHEMBL6859268 | 0.78 | DNM1 (0.44) | MAPK1CYP1A2CA12CA1CA2 | |
| SCHEMBL9720290 | 0.77 | CYP1A2 (0.48) | MAPK1CYP1A2CA12CA1CA2 | |
| SCHEMBL15016045 | 0.77 | CYP1A2 (0.48) | MAPK1CYP1A2CA12CA1CA2 |
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-6806289-B1 | SUCH AS AMMINE (2-AMINO-3-PICOLINE) DICHLOROPLATINUM(II); EFFICIENCY AND SELECTIVITY FOR DESTROYING TRANSFORMED CELLS | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2004-10-19 | — | — | US | disclosed |