Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | GLA | P06280 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29018288 | 1.00 | CTSD (0.57) | CTSDSMN1; SMN2ALDH1A1GAAGLA | |
| SCHEMBL29018039 | 0.88 | CTSD (0.61) | CTSDSMN1; SMN2ALDH1A1GAAGLA | |
| SCHEMBL29018037 | 0.88 | CTSD (0.61) | CTSDSMN1; SMN2ALDH1A1GAAGLA | |
| SCHEMBL13761295 | 0.79 | ALDH1A1 (0.67) | CTSDSMN1; SMN2ALDH1A1GAAGLA | |
| SCHEMBL1636418 | 0.79 | MEN1 (0.47) | ALDH1A1KDM4EMAPTTDP1MEN1 | |
| SCHEMBL1636233 | 0.79 | MEN1 (0.47) | ALDH1A1KDM4EMAPTTDP1MEN1 | |
| SCHEMBL29018043 | 0.78 | CTSD (0.55) | CTSDSMN1; SMN2ALDH1A1GAAGLA | |
| SCHEMBL29018047 | 0.78 | CTSD (0.55) | CTSDSMN1; SMN2ALDH1A1GAAGLA | |
| SCHEMBL8026101 | 0.78 | ALDH1A1 (0.65) | CTSDSMN1; SMN2ALDH1A1GAAGLA | |
| SCHEMBL29018044 | 0.76 | CTSD (0.56) | CTSDSMN1; SMN2ALDH1A1GLAKDM4E |
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-113105392-B | Chiral 2-imidazoline aniline compound and preparation method and application thereof | 浙江大学 | 2023-06-16 | — | — | CN | disclosed |
| CN-113105392-A | Chiral 2-imidazoline aniline compound and preparation method and application thereof | 浙江大学 | 2021-07-13 | — | — | CN | disclosed |