Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | POLQ | O75417 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | RXRG | P48443 | 1/20 | 0.36 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.36 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.36 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | RBP4 | P02753 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12203516 | 0.85 | ALDH1A1 (0.42) | ALDH1A1TDP1TSHRPOLQCA2 | |
| SCHEMBL8975793 | 0.82 | L3MBTL1 (0.46) | ALDH1A1TDP1TSHRPOLQCA2 | |
| SCHEMBL3852706 | 0.82 | AKR1B1 (0.55) | ALDH1A1TDP1TSHRPOLQKDM4E | |
| SCHEMBL643492 | 0.81 | POLQ (0.55) | ALDH1A1TDP1POLQKDM4EGAA | |
| SCHEMBL19224348 | 0.81 | ALDH1A1 (0.42) | ALDH1A1TDP1TSHRPOLQCA2 | |
| SCHEMBL6767819 | 0.79 | AKR1B1 (0.46) | ALDH1A1TDP1NR1H4AKR1B1 | |
| SCHEMBL14803742 | 0.78 | KDM4E (0.44) | ALDH1A1TDP1TSHRPOLQKDM4E | |
| SCHEMBL8000097 | 0.78 | ALDH1A1 (0.41) | ALDH1A1TDP1TSHRPOLQCA2 | |
| SCHEMBL24977628 | 0.75 | GABRA1 (0.44) | ALDH1A1AKR1B1GABRA1GABRB2 | |
| Hydrogen Peroxide SCHEMBL11570368 | 0.75 | GABRA1 (0.50) | ALDH1A1TDP1TSHRCA2KDM4E |
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-5661187-A | ADMINISTERING TO TREAT AN ALLERGIC OR INFLAMMATORY CONDITION; SIDE EFFECT REDUCTION | TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) | 1997-08-26 | — | — | US | disclosed |