Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 5/20 | 0.41 |
| ▸ | RAB9A | P51151 | 5/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18106906 | 0.82 | SMN1; SMN2 (0.63) | MAOBADORA2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL18106900 | 0.81 | SMN1; SMN2 (0.48) | MAOBADORA2AADORA2BADORA1SMN1; SMN2 | |
| SCHEMBL15944991 | 0.80 | LPAR2 (0.59) | MAOBADORA2AADORA2BADORA1SMN1; SMN2 | |
| SCHEMBL6118295 | 0.78 | MAOB (0.71) | MAOBADORA2AADORA2BADORA1SMN1; SMN2 | |
| SCHEMBL1012546 | 0.76 | LMNA (0.59) | MAOBADORA2AADORA2BADORA1SMN1; SMN2 | |
| SCHEMBL18106893 | 0.76 | TUBB4A (0.51) | SMN1; SMN2NPC1RAB9APOLBTDP1 | |
| SCHEMBL18106895 | 0.75 | LPAR2 (0.67) | MAOBADORA2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL18106907 | 0.75 | NPC1 (0.60) | MAOBADORA2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL18106909 | 0.74 | RAB9A (0.60) | MAOBADORA2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL18106896 | 0.74 | NPC1 (0.60) | MAOBADORA2ASMN1; SMN2NPC1RAB9A |
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-2742029-B1 | N-(BENZIMIMDAZOL-2-YL)-CYCLOPROPANE CARBOXAMIDES AS LYSOPHOSPHATIDIC ACID ANTAGONISTS | MERCK PATENT GMBH (DE) | 2016-10-05 | — | — | EP | claimed |