Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.48 |
| ▸ | NPC1 | O15118 | 6/20 | 0.44 |
| ▸ | RAB9A | P51151 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL21836228 | 0.75 | HCAR2 (0.42) | SMN1; SMN2NPC1RAB9AMAPTKDM4E | |
| SCHEMBL257344 | 0.72 | SMN1; SMN2 (0.57) | SMN1; SMN2NPC1RAB9AMAPTKDM4E | |
| SCHEMBL27829742 | 0.70 | ALDH1A1 (0.57) | SMN1; SMN2NPC1RAB9AMAPTKDM4E | |
| SCHEMBL3655946 | 0.70 | ALDH1A1 (0.61) | SMN1; SMN2NPC1RAB9AMAPTKDM4E | |
| SCHEMBL21836210 | 0.68 | FFAR2 (0.39) | SMN1; SMN2NPC1RAB9AMAPTKDM4E | |
| SCHEMBL21836209 | 0.68 | FFAR2 (0.39) | SMN1; SMN2NPC1RAB9AMAPTKDM4E | |
| SCHEMBL15197079 | 0.68 | ALDH1A1 (0.52) | SMN1; SMN2NPC1RAB9AMAPTKDM4E | |
| SCHEMBL21836245 | 0.67 | RBBP9 (0.51) | MAPTKMT2AALDH1A1TSHRCYP1A2 | |
| SCHEMBL3436651 | 0.67 | SMN1; SMN2 (0.67) | SMN1; SMN2NPC1RAB9AMAPTKDM4E | |
| SCHEMBL21836242 | 0.67 | RBBP9 (0.51) | MAPTKMT2AALDH1A1TSHRCYP1A2 |
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-117447464-A | Method for producing optically active compound | 首日生物制药公司 | 2024-01-26 | — | — | CN | disclosed |
| CN-111032047-B | Method for producing optically active compound | 多特疗法-1公司 | 2023-10-27 | — | — | CN | disclosed |