Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.62 |
| ▸ | TSHR | P16473 | 3/20 | 0.62 |
| ▸ | ESR1 | P03372 | 2/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.62 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.62 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.62 |
| ▸ | KDR | P35968 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 4/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | STS | P08842 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.50 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3027263 | 0.90 | ESR1 (0.64) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL22965811 | 0.87 | CYP4F2 (0.49) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL571300 | 0.86 | CA1 (0.59) | ALDH1A1ESR1TDP1LMNASMN1; SMN2 | |
| Isopropyl Alcohol SCHEMBL28972725 | 0.84 | ALDH1A1 (0.72) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL10952527 | 0.84 | ALDH1A1 (0.72) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL49950 | 0.84 | ALDH1A1 (0.84) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL5164197 | 0.83 | ALDH1A1 (0.66) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL20280574 | 0.83 | ACHE (0.56) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL8251798 | 0.83 | PKM (0.43) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL28758641 | 0.82 | ALDH1A1 (0.81) | ALDH1A1TSHRESR1TDP1CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20230203579-A1 | NANOARRAYS AND METHODS OF USE THEREOF | FIRST-CITIZENS BANK & TRUST COMPANY | 2023-06-29 | — | — | US | disclosed |