Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.47 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.47 |
| ▸ | PNMT | P11086 | 3/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL167075 | 0.91 | GABRA1 (0.54) | GABRA1GABRB2AKR1B1MEN1KMT2A | |
| SCHEMBL11829879 | 0.82 | GABRA1 (0.50) | GABRA1GABRB2AKR1B1MEN1KMT2A | |
| SCHEMBL11428422 | 0.82 | GABRA1 (0.46) | GABRA1GABRB2AKR1B1MEN1KMT2A | |
| SCHEMBL1072787 | 0.81 | GABRA1 (0.48) | GABRA1GABRB2AKR1B1MEN1KMT2A | |
| SCHEMBL30582776 | 0.81 | GABRA1 (0.48) | GABRA1GABRB2AKR1B1MEN1KMT2A | |
| SCHEMBL1536051 | 0.80 | GABRA1 (0.47) | GABRA1GABRB2PNMTAKR1B1DPP4 | |
| SCHEMBL1083025 | 0.79 | GABRA1 (0.47) | GABRA1GABRB2PNMTAKR1B1MEN1 | |
| Hydrochloric Acid SCHEMBL16429624 | 0.78 | GABRA1 (0.45) | GABRA1GABRB2PNMTAKR1B1DPP4 | |
| SCHEMBL174595 | 0.78 | GABRA1 (0.55) | GABRA1GABRB2AKR1B1MEN1KMT2A | |
| SCHEMBL7751350 | 0.78 | GABRA1 (0.46) | GABRA1GABRB2AKR1B1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0091054-B1 | 1-ALKYL-2-ISOCYANATOMETHYL-ISOCYANATO PHENYL AND/OR 1-ALKYL-4-ISOCYANATOMETHYL-ISOCYANATO PHENYL, METHOD FOR THEIR PREPARATION AND USE | BASF Aktiengesellschaft (DE) | 1985-10-02 | — | — | EP | disclosed |
| US-4512929-A | POLYURETHANE MONOMERS, PLANT SAFENING AGENT | BASF AKTIENGESELLSCHAFT (DE) | 1985-04-23 | — | — | US | disclosed |
| EP-0091054-A1 | 1-Alkyl-2-isocyanatomethyl-isocyanato phenyl and/or 1-alkyl-4-isocyanatomethyl-isocyanato phenyl, method for their preparation and use | BASF Aktiengesellschaft (DE) | 1983-10-12 | — | — | EP | disclosed |