Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | GABRP | O00591 | 1/20 | 0.39 |
| ▸ | GABRD | O14764 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.39 |
| ▸ | GABRE | P78334 | 1/20 | 0.39 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.39 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.39 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.39 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL147683 | 0.84 | POLB (0.67) | POLBCYP1A2MEN1LMNAKMT2A | |
| SCHEMBL31295740 | 0.84 | POLB (0.67) | POLBCYP1A2MEN1LMNAKMT2A | |
| SCHEMBL12465541 | 0.84 | POLB (0.52) | POLBCYP1A2GABRPGABRDGABRA1 | |
| SCHEMBL18704142 | 0.84 | POLB (0.57) | POLBCYP1A2GABRPGABRDGABRA1 | |
| SCHEMBL18742163 | 0.82 | POLB (0.70) | POLBCYP1A2GABRPGABRDGABRA1 | |
| SCHEMBL14385079 | 0.82 | POLB (0.50) | POLBCYP1A2MEN1LMNAKMT2A | |
| SCHEMBL14385062 | 0.82 | POLB (0.50) | POLBCYP1A2GABRPGABRDGABRA1 | |
| SCHEMBL18742213 | 0.81 | POLB (0.58) | POLBCYP1A2MEN1LMNAKMT2A | |
| SCHEMBL18704044 | 0.78 | POLB (0.46) | POLBCYP1A2MEN1LMNAKMT2A | |
| SCHEMBL17164043 | 0.78 | POLB (0.71) | POLBCYP1A2LMNAKDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017060488-A1 | NEW TRPA1 ANTAGONISTS | ALMIRALL, S.A. (ES) | 2017-04-13 | — | — | WO | disclosed |
| EP-0109624-A2 | Process for producing shaped articles made from polyurethane-polyurea which may be cellular | BASF Aktiengesellschaft (DE) | 1984-05-30 | — | — | EP | disclosed |