Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.45 |
| ▸ | FEN1 | P39748 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7339923 | 0.81 | RAB9A (0.55) | ALDH1A1NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL4637854 | 0.80 | LMNA (0.53) | ALDH1A1NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL20551071 | 0.79 | ALDH1A1 (0.49) | ALDH1A1NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL28854265 | 0.78 | MEN1 (0.65) | ALDH1A1NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL27581546 | 0.78 | MEN1 (0.60) | ALDH1A1NPC1KMT2AMEN1L3MBTL1 | |
| SCHEMBL4637996 | 0.78 | NPC1 (0.56) | ALDH1A1NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL29112376 | 0.78 | CYP1A2 (0.67) | ALDH1A1NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL20552841 | 0.76 | ALDH1A1 (0.47) | ALDH1A1NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL9341422 | 0.76 | TSHR (0.57) | ALDH1A1NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL27208789 | 0.76 | ERCC5 (0.53) | ALDH1A1NPC1RAB9AKMT2AMEN1 |
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-0804440-B1 | TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS | WYETH CORP (US) | 2007-12-19 | — | — | EP | disclosed |