Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MDM2 | Q00987 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15471556 | 0.86 | KMT2A (0.49) | MDM2TSHRALDH1A1NR4A2NPC1 | |
| SCHEMBL29029682 | 0.83 | MDM2 (0.57) | MDM2TSHRPGRADRA2AADRA2B | |
| SCHEMBL29029678 | 0.80 | MDM2 (0.50) | MDM2TSHRPGRADRA2AADRA2B | |
| SCHEMBL27836482 | 0.79 | MDM2 (0.40) | MDM2TSHRPDCD1CD274PGR | |
| SCHEMBL29193466 | 0.76 | PDCD1 (0.49) | MDM2TSHRPDCD1CD274PGR | |
| SCHEMBL28576168 | 0.76 | GABRP (0.42) | TSHRLMNACYP1A2 | |
| SCHEMBL18327107 | 0.76 | CYP1A2 (0.52) | MDM2TSHRPGRADRA2AADRA2B | |
| SCHEMBL15210032 | 0.76 | PGR (0.42) | MDM2TSHRPGRADRA2AADRA2B | |
| SCHEMBL8946464 | 0.74 | KMT2A (0.56) | MDM2ALDH1A1NR4A2NPC1RAB9A | |
| SCHEMBL4666972 | 0.74 | MAPT (0.49) | MDM2TSHRPGRADRA2AADRA2B |
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-112778133-A | high-pH-value chrome tanning auxiliary agent containing polyfunctional group structure and preparation method and application thereof | 南京工业大学 | 2021-05-11 | — | — | CN | disclosed |