Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10571237 | 0.82 | GAA (0.54) | NPC1KMT2AHSD11B1ALDH1A1KDM4E | |
| SCHEMBL426162 | 0.75 | ALDH1A1 (0.52) | NPC1KMT2AHSD11B1ALDH1A1KDM4E | |
| SCHEMBL5664200 | 0.74 | CA2 (0.64) | NPC1KMT2AHSD11B1ALDH1A1KDM4E | |
| SCHEMBL7413114 | 0.72 | ALDH1A1 (0.50) | NPC1KMT2AHSD11B1ALDH1A1KDM4E | |
| SCHEMBL6646708 | 0.71 | KMT2A (0.43) | NPC1KMT2AALDH1A1MMP1GAA | |
| SCHEMBL10570343 | 0.71 | MMP13 (0.56) | KMT2AALDH1A1MMP1MEN1POLB | |
| SCHEMBL2914219 | 0.71 | ALDH1A1 (0.56) | NPC1KMT2AHSD11B1ALDH1A1KDM4E | |
| SCHEMBL10568403 | 0.71 | ALDH1A1 (0.48) | NPC1KMT2AHSD11B1ALDH1A1KDM4E | |
| SCHEMBL11658315 | 0.70 | ALDH1A1 (0.50) | NPC1KMT2AHSD11B1ALDH1A1KDM4E | |
| SCHEMBL20448658 | 0.70 | ALDH1A1 (0.50) | NPC1KMT2AHSD11B1ALDH1A1KDM4E |
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-4810706-A | ANTIHISTAMINES | RECHERCHE SYNTEX (FR) | 1989-03-07 | — | — | US | disclosed |
| EP-0227077-A1 | Piperazine derivatives of theophylline and theobromine | LABORATOIRES SYNTEX S.A. (FR) | 1987-07-01 | — | — | EP | disclosed |