Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.36 |
| ▸ | GABRP | O00591 | 1/20 | 0.36 |
| ▸ | GABRD | O14764 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.36 |
| ▸ | GABRE | P78334 | 1/20 | 0.36 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.36 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27793005 | 0.84 | MAPT (0.46) | LMNAALDH1A1POLBNPC1RAB9A | |
| SCHEMBL27792948 | 0.84 | TSHR (0.45) | LMNAFGFR1ACHEARALDH1A1 | |
| SCHEMBL27792987 | 0.83 | NPC1 (0.43) | S100A4LMNAFGFR1ACHEGABRA1 | |
| SCHEMBL27814220 | 0.83 | ALDH1A1 (0.51) | S100A4FGFR1ALDH1A1TDP1MEN1 | |
| SCHEMBL21670811 | 0.75 | KDM4E (0.41) | S100A4TRPV1LMNAFGFR1ACHE | |
| SCHEMBL16862770 | 0.75 | LMNA (0.41) | S100A4TRPV1LMNAACHEGABRA1 | |
| SCHEMBL30838434 | 0.75 | KDM4E (0.41) | S100A4TRPV1LMNAFGFR1ACHE | |
| SCHEMBL29430733 | 0.75 | ALDH1A1 (0.61) | S100A4TRPV1LMNAACHEGABRA1 | |
| SCHEMBL100456 | 0.75 | ALDH1A1 (0.61) | S100A4TRPV1LMNAACHEGABRA1 | |
| SCHEMBL204357 | 0.74 | S100A4 (0.61) | S100A4TRPV1ACHEGABRA1GABRG2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101817774-B | Method for preparing 2-(2-nitrophenyl) pyrrole and 2,5-bis(2-nitrophenyl) pyrrole compounds | YUEFEI HU | 2012-03-21 | — | — | CN | disclosed |
| CN-101817774-A | Method for preparing 2-(2-nitrophenyl) pyrrole and 2,5-bis(2-nitrophenyl) pyrrole compounds | YUEFEI HU | 2010-09-01 | — | — | CN | disclosed |