Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL18908934 | 0.85 | DDR1 (0.47) | NR1H2DDR1 | |
| SCHEMBL15381987 | 0.84 | DDR1 (0.49) | NR1H2DDR1 | |
| SCHEMBL17320456 | 0.82 | NR1H2 (0.49) | NR1H2ACHEKDM4EALDH1A1MEN1 | |
| SCHEMBL14315490 | 0.82 | MLNR (0.52) | NR1H2KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL18403054 | 0.81 | DDR1 (0.47) | DDR1 | |
| SCHEMBL17191552 | 0.81 | ALDH1A1 (0.52) | NR1H2TSHRSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL24565992 | 0.80 | NR1H2 (0.46) | NR1H2KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL12426532 | 0.80 | NR1H2 (0.55) | NR1H2SMN1; SMN2KDM4EALDH1A1MEN1 | |
| SCHEMBL19634231 | 0.79 | PDE2A (0.48) | TSHRNPC1RAB9ASMN1; SMN2ACHE | |
| SCHEMBL19634249 | 0.79 | PDE2A (0.48) | TSHRNPC1RAB9ASMN1; SMN2ACHE |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010092489-A1 | DERIVATIVES OF AZAINDOLES AS INHIBITORS OF PROTEIN KINASES ABL AND SRC | NOVA DECISION (FR) | 2010-08-19 | — | — | WO | disclosed |