Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F7 | P08709 | 1/20 | 0.38 |
| ▸ | F3 | P13726 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 3/20 | 0.37 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | GMNN | O75496 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL289814 | 0.77 | — | — | |
| SCHEMBL27768202 | 0.73 | TDP1 (0.39) | F7F3CES2ALDH1A1TDP1 | |
| SCHEMBL2360898 | 0.73 | ACHE (0.42) | F7F3ALDH1A1TSHRMAPT | |
| SCHEMBL2369749 | 0.73 | — | — | |
| SCHEMBL4552804 | 0.71 | TRPA1 (0.50) | LMNAMAPTGPR84 | |
| SCHEMBL10315050 | 0.71 | HDAC2 (0.44) | ALDH1A1TDP1USP2LMNACYP1A2 | |
| SCHEMBL25489323 | 0.70 | — | — | |
| SCHEMBL15846758 | 0.70 | KMT2A (0.41) | F7F3TSHRGMNNUSP2 | |
| SCHEMBL11517580 | 0.70 | ALDH1A1 (0.38) | F7F3ALDH1A1TSHRGMNN | |
| SCHEMBL680154 | 0.69 | — | — |
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-105531282-A | Alkaloid compositions derived from black currant species for treating conditions associated with mitochondrial function or inhibition of PDE4, PDE5 and IKK-beta | ASIROS AS | 2016-04-27 | — | — | CN | disclosed |