Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.41 |
| ▸ | TLR4 | O00206 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7065633 | 0.86 | SIGMAR1 (0.45) | ALDH1A1TSHR | |
| SCHEMBL6820894 | 0.84 | KMT2A (0.52) | ALDH1A1GAANPC1RAB9ATSHR | |
| SCHEMBL6826385 | 0.82 | SIGMAR1 (0.43) | ALDH1A1GAANPC1RAB9AKMT2A | |
| SCHEMBL6825996 | 0.80 | CHRM2 (0.42) | ALDH1A1NPC1RAB9ATSHRMEN1 | |
| SCHEMBL6826045 | 0.78 | SSTR4 (0.39) | ALDH1A1GAACNR2CNR1 | |
| SCHEMBL2045062 | 0.77 | NPC1 (0.59) | ALDH1A1GAANPC1RAB9ATSHR | |
| SCHEMBL15046662 | 0.76 | ALDH1A1 (0.61) | ALDH1A1GAATSHRMEN1KMT2A | |
| SCHEMBL17193340 | 0.76 | NPC1 (0.60) | ALDH1A1GAANPC1RAB9ATSHR | |
| SCHEMBL6820817 | 0.76 | NPC1 (0.53) | ALDH1A1GAANPC1RAB9ATSHR | |
| SCHEMBL15046833 | 0.74 | ALDH1A1 (0.65) | ALDH1A1GAATSHRMEN1KMT2A |
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-2004048352-A2 | 2-CYANOPYRROLIDINES AND THEIR ANALOGUES AS DPP-IV INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-06-10 | — | — | WO | disclosed |