Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CCR1 | P32246 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MPI | P34949 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28936482 | 1.00 | CYP1A2 (0.38) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL29955945 | 0.79 | CYP1A2 (0.41) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL1599165 | 0.79 | CYP1A2 (0.41) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL31019939 | 0.78 | CYP1A2 (0.38) | CYP1A2ALDH1A1CCR1RAB9ACCR5 | |
| SCHEMBL623439 | 0.77 | TDP1 (0.36) | ALDH1A1TSHRCCR1CCR5KDM4E | |
| SCHEMBL29438802 | 0.77 | TDP1 (0.36) | ALDH1A1TSHRCCR1CCR5KDM4E | |
| SCHEMBL28910008 | 0.76 | ALDH1A1 (0.44) | CYP1A2ALDH1A1CCR1CCR5KDM4E | |
| SCHEMBL23726224 | 0.74 | TRIM24 (0.36) | ALDH1A1LMNAMEN1KMT2ATHRB | |
| SCHEMBL2395774 | 0.74 | ALDH1A1 (0.53) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL21241731 | 0.74 | TRIM24 (0.45) | CYP1A2ALDH1A1TSHRCCR1RAB9A |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |