Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRC | Q99895 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | PNMT | P11086 | 1/20 | 0.37 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | HTR5A | P47898 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.33 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.33 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.33 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9410520 | 0.82 | CLCN2 (0.38) | CTRCPNMTCLCN2GABRA1GABRB2 | |
| SCHEMBL398748 | 0.80 | CTRC (0.36) | CTRCCLCN2GABRA1GABRB2HTR2C | |
| SCHEMBL30862051 | 0.80 | CTRC (0.36) | CTRCCLCN2GABRA1GABRB2HTR2C | |
| SCHEMBL10341210 | 0.80 | ATP4A (0.43) | CTRCCLCN2GABRA1GABRB2CSNK2A2 | |
| SCHEMBL1547630 | 0.78 | CLCN2 (0.45) | CTRCPNMTCLCN2GABRA1GABRB2 | |
| SCHEMBL12797849 | 0.77 | POLB (0.41) | CTRCGABRA1GABRB2TAAR1POLB | |
| SCHEMBL8082902 | 0.74 | CTRC (0.39) | CTRCPNMTCLCN2GABRA1GABRB2 | |
| SCHEMBL2662577 | 0.74 | CTRC (0.39) | CTRCPNMTCLCN2GABRA1GABRB2 | |
| SCHEMBL3457088 | 0.74 | DPP4 (0.47) | CLCN2GABRA1GABRB2 | |
| SCHEMBL8932346 | 0.74 | SLC6A2 (0.36) | CLCN2CSNK2A1POLBSLC6A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5026815-A | Chlorinated 4,4**1-methylenebisanilines | LONZA LTD. (CH) | 1991-06-25 | — | — | US | claimed |
| EP-0387894-B1 | Chain-extending agent for 4,4'-diphenyl methane diisocyanate prepolymers for casted polyurethane elastomers | LONZA AG (CH) | 1994-06-08 | — | — | EP | disclosed |
| US-5026815-A | Chlorinated 4,4**1-methylenebisanilines | LONZA LTD. (CH) | 1991-06-25 | — | — | US | disclosed |
| EP-0387894-A2 | Chain-extending agent for 4,4'-diphenyl methane diisocyanate prepolymers for casted polyurethane elastomers | LONZA AG (CH) | 1990-09-19 | — | — | EP | disclosed |