Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5806022 | 0.84 | CDC7 (0.45) | SMN1; SMN2TP53LMNAALDH1A1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL5811071 | 0.74 | KMT2A (0.39) | SMN1; SMN2TP53LMNAMMP13ALDH1A1 | |
| SCHEMBL1736683 | 0.73 | BCHE (0.53) | SMN1; SMN2ALDH1A1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL5809021 | 0.72 | TSHR (0.47) | SMN1; SMN2TP53LMNAALDH1A1TDP1 | |
| SCHEMBL26964234 | 0.72 | TP53 (0.53) | SMN1; SMN2TP53LMNAMMP13ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5808484 | 0.71 | TSHR (0.47) | SMN1; SMN2TP53LMNAALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL5810277 | 0.70 | TSHR (0.38) | SMN1; SMN2TP53LMNAMMP13ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5810062 | 0.70 | DYRK1A (0.44) | SMN1; SMN2TP53LMNAALDH1A1TDP1 | |
| SCHEMBL26964231 | 0.70 | SMN1; SMN2 (0.50) | SMN1; SMN2TP53LMNAALDH1A1TDP1 | |
| SCHEMBL29801034 | 0.70 | SMN1; SMN2 (0.50) | SMN1; SMN2TP53LMNAALDH1A1TDP1 |
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-2006025717-A1 | PYRROLO[2,3-c]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | YUHAN CORPORATION (KR) | 2006-03-09 | — | — | WO | disclosed |