Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL3190680 | 0.81 | MEP1B (0.53) | NPC1RAB9AMEN1KMT2ACA12 | |
| SCHEMBL6770221 | 0.81 | CES2 (0.43) | NPC1RAB9AMEN1KMT2ACA12 | |
| SCHEMBL13895390 | 0.78 | MEN1 (0.57) | NPC1RAB9AMEN1KMT2ALMNA | |
| SCHEMBL13368580 | 0.78 | NPC1 (0.49) | NPC1RAB9AMEN1KMT2AOPRM1 | |
| Malonic Acid SCHEMBL16431221 | 0.78 | NPC1 (0.47) | NPC1RAB9AMEN1KMT2ACA12 | |
| SCHEMBL7087904 | 0.77 | TSHR (0.41) | NPC1RAB9AMEN1KMT2ACA12 | |
| SCHEMBL26802 | 0.76 | ALDH1A1 (0.48) | NPC1RAB9AMEN1KMT2ACA12 | |
| SCHEMBL28517819 | 0.76 | MEN1 (0.46) | NPC1RAB9AMEN1KMT2ACA12 | |
| SCHEMBL2834704 | 0.75 | ALDH1A1 (0.48) | NPC1RAB9AMEN1KMT2ALMNA | |
| SCHEMBL5188166 | 0.74 | NPC1 (0.57) | NPC1RAB9AMEN1KMT2AOPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3288948-B1 | FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR MODULATING FARNESOID X RECEPTORS | NOVARTIS AG (CH) | 2019-11-20 | — | — | EP | disclosed |