Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HAAO | P46952 | 1/20 | 0.39 |
| ▸ | 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 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL31389208 | 0.85 | CYP1A2 (0.58) | CYP1A2TSHRHAAOGABRPGABRD | |
| SCHEMBL128319 | 0.85 | CYP1A2 (0.58) | CYP1A2TSHRHAAOGABRPGABRD | |
| Ammonia Solution, Strong SCHEMBL29137499 | 0.83 | CYP1A2 (0.55) | CYP1A2TSHRHAAOGABRPGABRD | |
| SCHEMBL2085354 | 0.83 | ALDH1A1 (0.44) | CYP1A2TSHRHAAOGABRPGABRD | |
| SCHEMBL27289184 | 0.83 | CYP1A2 (0.41) | CYP1A2TSHRHAAOGABRPGABRD | |
| SCHEMBL6155380 | 0.83 | GRM1 (0.51) | CYP1A2TSHRHAAOGABRPGABRD | |
| SCHEMBL5737114 | 0.81 | KDM4E (0.40) | CYP1A2HAAOGABRPGABRDGABRA1 | |
| SCHEMBL148622 | 0.81 | GABRP (0.44) | CYP1A2TSHRHAAOGABRPGABRD | |
| SCHEMBL10914869 | 0.81 | GABRP (0.44) | CYP1A2HAAOGABRPGABRDGABRA1 | |
| SCHEMBL28598130 | 0.81 | CYP1A2 (0.39) | CYP1A2TSHRHAAOGABRPGABRD |
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-115260096-B | Method for synthesizing dihydroisoquinolinones based on carbon monoxide gas or carbon monoxide substitution source | 武汉大学 | 2024-04-09 | — | — | CN | disclosed |
| CN-104507928-A | Heterocyclic modulators of lipid synthesis | 3 V BIOSCIENCES INC | 2015-04-08 | — | — | CN | disclosed |