Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGAM | O43451 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | SI | P14410 | 1/20 | 0.42 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.42 |
| ▸ | FBP1 | P09467 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL260831 | 1.00 | MGAM (0.42) | MGAMGAASIMGAM2FBP1 | |
| SCHEMBL260240 | 0.81 | FBP1 (0.41) | FBP1L3MBTL1TDP1TSHRCYP1A2 | |
| SCHEMBL260657 | 0.80 | CYP1A2 (0.40) | FBP1L3MBTL1TDP1TSHRCYP1A2 | |
| SCHEMBL2884271 | 0.79 | GAA (0.46) | MGAMGAASIMGAM2FBP1 | |
| SCHEMBL2884268 | 0.79 | GAA (0.46) | MGAMGAASIMGAM2FBP1 | |
| SCHEMBL260294 | 0.71 | CYP1A2 (0.45) | MGAMGAASIMGAM2FBP1 | |
| SCHEMBL6009063 | 0.70 | TSHR (0.55) | MGAMGAASIMGAM2L3MBTL1 | |
| SCHEMBL475205 | 0.67 | CYP1A2 (0.72) | L3MBTL1TDP1TSHRCYP1A2HSD17B10 | |
| SCHEMBL475201 | 0.67 | CYP1A2 (0.72) | L3MBTL1TDP1TSHRCYP1A2HSD17B10 | |
| SCHEMBL6007713 | 0.66 | TDP1 (0.52) | MGAMGAASIMGAM2L3MBTL1 |
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-8163752-B2 | Tricyclic anilide heterocyclic CGRP receptor antagonists | Merck, Sharp & Dohme Corp. (US) | 2012-04-24 | — | — | US | disclosed |
| US-8133891-B2 | Tricyclic anilide spirolactam CGRP receptor antagonists | Merck, Sharp & Dohme Corp. (US) | 2012-03-13 | — | — | US | disclosed |