Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | 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 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.30 |
| ▸ | APOBEC3G | Q9HC16 | 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 | |
|---|---|---|---|---|
| Diethylaminoethanol SCHEMBL853091 | 0.87 | MEN1 (0.42) | MEN1POLBKMT2AALDH1A1CYP1A2 | |
| SCHEMBL19206141 | 0.82 | — | — | |
| SCHEMBL9242 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL29203168 | 0.79 | PAOX (0.41) | MEN1KMT2AALDH1A1PAOXNPSR1 | |
| SCHEMBL27813421 | 0.79 | PAOX (0.41) | MEN1KMT2AALDH1A1PAOXNPSR1 | |
| SCHEMBL27813443 | 0.79 | PAOX (0.41) | MEN1KMT2AALDH1A1PAOXNPSR1 | |
| Acrylic Acid SCHEMBL11725694 | 0.78 | ALDH1A1 (0.50) | MEN1POLBKMT2AALDH1A1PAOX | |
| SCHEMBL2845508 | 0.77 | PAOX (0.39) | MEN1KMT2AALDH1A1PAOXNPSR1 | |
| SCHEMBL3427325 | 0.77 | HSD17B10 (0.41) | MEN1KMT2AALDH1A1PAOXNPSR1 | |
| SCHEMBL11713997 | 0.77 | HSD17B10 (0.41) | MEN1KMT2AALDH1A1PAOXNPSR1 |
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-5948945-A | Prevention of spontaneous decomposition of gaseous acetylene | BASF AKTIENGESELLSCHAFT (DE) | 1999-09-07 | — | — | US | disclosed |