Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.33 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL14417850 | 0.88 | ATM (0.47) | ALDH1A1MEN1KMT2ATDP1HPGD | |
| SCHEMBL14417851 | 0.84 | ALDH1A1 (0.38) | ALDH1A1MEN1KMT2ATDP1HPGD | |
| SCHEMBL14417828 | 0.83 | NAMPT (0.42) | ALDH1A1MEN1KMT2ATDP1HPGD | |
| SCHEMBL12584114 | 0.81 | ALDH1A1 (0.46) | ALDH1A1MEN1KMT2ATDP1HPGD | |
| SCHEMBL9723662 | 0.79 | — | — | |
| SCHEMBL13360768 | 0.78 | ALDH1A1 (0.52) | ALDH1A1MEN1KMT2ALMNAL3MBTL1 | |
| SCHEMBL21946673 | 0.78 | ALDH1A1 (0.35) | ALDH1A1MEN1KMT2ATDP1HPGD | |
| SCHEMBL25810288 | 0.78 | ALDH1A1 (0.55) | ALDH1A1HPGDUSP2CYP3A4HSD17B10 | |
| SCHEMBL8903167 | 0.77 | NAMPT (0.37) | ALDH1A1MEN1KMT2ATDP1HPGD | |
| SCHEMBL4438715 | 0.77 | ALDH1A1 (0.53) | ALDH1A1LMNASMN1; SMN2NAMPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7268150-B2 | 2-cyano-4-fluoropyrrolidine derivative or its salt | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 2007-09-11 | — | — | US | disclosed |
| US-7268150-B2 | 2-cyano-4-fluoropyrrolidine derivative or its salt | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 2007-09-11 | — | — | US | disclosed |