Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.35 |
| ▸ | TYMS | P04818 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23709776 | 0.81 | AR (0.41) | ARTSHR | |
| SCHEMBL642701 | 0.77 | KMT2A (0.40) | TSHRLMNAMEN1HTTKMT2A | |
| SCHEMBL15067341 | 0.76 | AR (0.40) | ARKDM4ELMNANPSR1SMN1; SMN2 | |
| SCHEMBL10415028 | 0.76 | TSHR (0.45) | ARTSHRALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL3716331 | 0.76 | HSD17B10 (0.45) | ARTSHRLMNAHTTALDH1A1 | |
| SCHEMBL4120274 | 0.74 | MEN1 (0.39) | TSHRLMNAMEN1HTTKMT2A | |
| SCHEMBL216701 | 0.73 | HSD17B10 (0.50) | ARTSHRLMNAMEN1HTT | |
| SCHEMBL24804422 | 0.72 | MEN1 (0.38) | TSHRMEN1HTTKMT2AALDH1A1 | |
| SCHEMBL2652648 | 0.72 | TSHR (0.41) | TSHRKDM4EMEN1HTTKMT2A | |
| SCHEMBL10415137 | 0.72 | ALDH1A1 (0.45) | ARLMNAHTTALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018130174-A1 | PYRROLO[2,3-C]PYRIDINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF IN MEDICINE | 江苏豪森药业集团有限公司 | 2018-07-19 | — | — | WO | disclosed |