Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.40 |
| ▸ | YAP1 | P46937 | 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 | |
|---|---|---|---|---|
| SCHEMBL7136587 | 0.87 | L3MBTL1 (0.53) | ALDH1A1MAPTL3MBTL1MAPK1NPC1 | |
| Hydrochloric Acid SCHEMBL7643194 | 0.80 | TGM2 (0.39) | ALDH1A1MAPTHTTRAB9AKMT2A | |
| SCHEMBL27706952 | 0.80 | SIGMAR1 (0.59) | ALDH1A1MAPTLMNAL3MBTL1MAPK1 | |
| SCHEMBL7644917 | 0.79 | ALDH1A1 (0.48) | ALDH1A1MAPTLMNAL3MBTL1MAPK1 | |
| SCHEMBL5724167 | 0.79 | ALDH1A1 (0.67) | ALDH1A1MAPTLMNAMEN1KMT2A | |
| SCHEMBL5012643 | 0.78 | ALDH1A1 (0.58) | ALDH1A1MAPTLMNAL3MBTL1MAPK1 | |
| SCHEMBL4024599 | 0.78 | CCR5 (0.60) | CCR5 | |
| SCHEMBL7463367 | 0.77 | ALDH1A1 (0.48) | ALDH1A1MAPTLMNAL3MBTL1GPR119 | |
| SCHEMBL8449178 | 0.77 | ALDH1A1 (0.48) | ALDH1A1MAPTLMNAL3MBTL1GPR119 | |
| SCHEMBL8094828 | 0.75 | ALDH1A1 (0.45) | ALDH1A1MAPTLMNAL3MBTL1CCR5 |
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-6476054-B1 | Cyclic amine modulators of chemokine receptor activity | MERCK & CO., INC. | 2002-11-05 | — | — | US | disclosed |
| US-6140349-A | FOR PROPHYLAXIS AND THERAPY OF HUMAN IMMUNODEFICIENCY VIRUS(HIV) INFECTIONS AND ACQUIRED IMMUNODEDICIENCY SYNDROME | MERCK & CO., INC. (US) | 2000-10-31 | — | — | US | disclosed |