Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 5/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | BLM | P54132 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8580683 | 0.84 | ALDH1A1 (0.40) | ALDH1A1MAPTKDM4ETDP1TSHR | |
| SCHEMBL8578798 | 0.80 | CYP1A2 (0.51) | ALDH1A1CYP1A2MEN1KMT2AGAA | |
| SCHEMBL8895700 | 0.74 | ALDH1A1 (0.42) | ALDH1A1MAPTKDM4ETDP1TSHR | |
| SCHEMBL8581468 | 0.73 | PSMD14 (0.40) | ALDH1A1MAPTTDP1CYP1A2MEN1 | |
| SCHEMBL8580718 | 0.73 | MAPT (0.42) | ALDH1A1MAPTKDM4ETDP1TSHR | |
| SCHEMBL8580633 | 0.72 | CYP1A2 (0.40) | ALDH1A1CYP1A2MEN1KMT2AGAA | |
| SCHEMBL8585037 | 0.71 | CYP1A2 (0.47) | ALDH1A1CYP1A2MEN1KMT2AGAA | |
| SCHEMBL5461528 | 0.70 | POLB (0.59) | ALDH1A1MAPTKDM4ETDP1TSHR | |
| SCHEMBL8991939 | 0.70 | PTGS2 (0.44) | ALDH1A1MAPTKDM4ETDP1TSHR | |
| SCHEMBL9027935 | 0.70 | PTGS2 (0.44) | ALDH1A1MAPTKDM4ETDP1TSHR |
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-5731336-A | USING ARYL-SUBSTITUTED RHODAMINES | ELI LILLY AND COMPANY (US) | 1998-03-24 | — | — | US | disclosed |