Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.61 |
| ▸ | DHODH | Q02127 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.48 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.48 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.48 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.48 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL30443064 | 1.00 | ACHE (0.61) | ACHEDHODHRAB9ANPC1HPGD | |
| SCHEMBL19577801 | 0.97 | ACHE (0.65) | ACHEDHODHRAB9ANPC1HPGD | |
| SCHEMBL29057032 | 0.95 | ACHE (0.55) | ACHEDHODHRAB9ANPC1HPGD | |
| SCHEMBL30493472 | 0.95 | ACHE (0.55) | ACHEDHODHRAB9ANPC1HPGD | |
| SCHEMBL29373699 | 0.94 | ACHE (0.69) | ACHEDHODHRAB9ANPC1HPGD | |
| SCHEMBL31471473 | 0.94 | ACHE (0.69) | ACHEDHODHRAB9ANPC1HPGD | |
| SCHEMBL301247 | 0.94 | ACHE (0.69) | ACHEDHODHRAB9ANPC1HPGD | |
| SCHEMBL28043537 | 0.92 | TSHR (0.53) | ACHEDHODHRAB9ANPC1HPGD | |
| SCHEMBL9419197 | 0.92 | ACHE (0.67) | ACHEDHODHRAB9ANPC1HPGD | |
| SCHEMBL18797759 | 0.91 | ACHE (0.65) | ACHERAB9ANPC1HPGDTSHR |
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-105037072-B | A kind of synthetic method of 1,3,5-triarylbenzenes compound | 华侨大学 | 2016-11-30 | — | — | CN | disclosed |
| CN-105037072-A | Synthetic method for 1,3,5-triarylbenzene compound | UNIV HUAQIAO | 2015-11-11 | — | — | CN | disclosed |