Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 2/20 | 0.62 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.58 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.56 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.56 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.56 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.56 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.56 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.56 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.56 |
| ▸ | NOS2 | P35228 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.53 |
| ▸ | TUBB | P07437 | 1/20 | 0.53 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.53 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.53 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.53 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.53 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.53 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.53 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL27183195 | 0.86 | TUBB4A (0.62) | AKR1B1TAAR1GABRA1GABRG2GABRB3 | |
| SCHEMBL20682611 | 0.86 | POLB (0.68) | AKR1B1TAAR1GABRA1GABRG2GABRB3 | |
| SCHEMBL28349603 | 0.82 | PTPN1 (0.54) | AKR1B1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL27793825 | 0.82 | AKR1B1 (0.75) | AKR1B1TAAR1GABRA1GABRG2GABRB3 | |
| SCHEMBL17263517 | 0.82 | AKR1B1 (0.68) | AKR1B1TAAR1PTPN1NOS2POLB | |
| SCHEMBL17263518 | 0.81 | AKR1B1 (0.76) | AKR1B1TAAR1PTPN1NOS2TUBB4A | |
| SCHEMBL18274930 | 0.81 | TNKS2 (0.56) | AKR1B1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL30080050 | 0.81 | TAAR1 (0.77) | TAAR1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL723511 | 0.81 | TAAR1 (0.77) | TAAR1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL12644485 | 0.81 | GABRA1 (0.59) | AKR1B1TAAR1GABRA1GABRG2GABRB3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116747210-A | Application of bibenzyl compound in preparation of anti-inflammatory drugs | 中国热带农业科学院热带生物技术研究所 | 2023-09-15 | — | — | CN | disclosed |