Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20835285 | 0.95 | MAPT (0.32) | MAPT | |
| SCHEMBL7152117 | 0.88 | CYP1A2 (0.41) | MAPTCYP1A2CYP2C9HPGDMAPK1 | |
| SCHEMBL8661196 | 0.83 | MAPT (0.35) | MAPTCYP1A2CYP2C9HPGDMAPK1 | |
| SCHEMBL23863517 | 0.78 | KCNH2 (0.36) | — | |
| SCHEMBL25044832 | 0.77 | — | — | |
| SCHEMBL12764441 | 0.76 | PYCR1 (0.33) | — | |
| SCHEMBL8561940 | 0.76 | MAPT (0.34) | MAPT | |
| SCHEMBL8335192 | 0.75 | KCNH2 (0.38) | — | |
| SCHEMBL8472078 | 0.74 | — | — | |
| Trolamine SCHEMBL28181964 | 0.69 | MAPT (0.44) | MAPTCYP1A2CYP2C9HPGDMAPK1 |
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-6350714-B1 | ACTIVATION GROUP 1B OR 2B METAL OR COMPOUND BY REACTING WITH ALKYNE AND CARBONYL COMPOUND; ALKYNYLATION, AMINOALKYLATION, CATALYSIS | BASF AKTIENGESELLSCHAFT (DE) | 2002-02-26 | — | — | US | disclosed |