Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL515046 | 0.79 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1 | |
| SCHEMBL515045 | 0.79 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1 | |
| SCHEMBL5697502 | 0.76 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1 | |
| SCHEMBL9567419 | 0.76 | CYP19A1 (0.46) | ALDH1A1SMN1; SMN2NPC1RAB9AHSD17B10 | |
| SCHEMBL2154210 | 0.75 | SMN1; SMN2 (0.49) | ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1 | |
| SCHEMBL2153612 | 0.75 | CYP19A1 (0.48) | ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1 | |
| SCHEMBL6690636 | 0.75 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1 | |
| SCHEMBL10953659 | 0.73 | CYP1A2 (0.56) | ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1 | |
| SCHEMBL19356915 | 0.73 | CYP19A1 (0.47) | ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1 | |
| SCHEMBL3987067 | 0.72 | CYP19A1 (0.43) | ALDH1A1SMN1; SMN2NPC1RAB9AHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-9662335-B2 | Heteroaryl substituted pyrrolo[2,3-B] pyridines and pyrrolo[2,3-B] pyrimidines as janus kinase inhibitors | INCYTE HOLDINGS CORPORATION (US) | 2017-05-30 | — | — | US | disclosed |