Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CCR1 | P32246 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CCR5 | P51681 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1599165 | 1.00 | CYP1A2 (0.41) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL124643 | 0.79 | KDM4E (0.44) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL29956425 | 0.79 | ALDH1A1 (0.53) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL27732098 | 0.79 | ERN1 (0.40) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL28936482 | 0.79 | CYP1A2 (0.38) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL2395774 | 0.79 | ALDH1A1 (0.53) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL30852206 | 0.79 | KDM4E (0.44) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL29956875 | 0.79 | CYP1A2 (0.38) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL21241731 | 0.79 | TRIM24 (0.45) | CYP1A2ALDH1A1TSHRCCR1RAB9A | |
| SCHEMBL9831052 | 0.78 | ALDH1A1 (0.41) | CYP1A2ALDH1A1TSHRRAB9AKDM4E |
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 |