Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | THRA | P10827 | 7/20 | 0.41 |
| ▸ | THRB | P10828 | 7/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10544258 | 0.84 | ALDH1A1 (0.47) | ALDH1A1THRATHRBCNR2NPC1 | |
| SCHEMBL10549257 | 0.83 | THRA (0.41) | ALDH1A1THRATHRBCNR2KDM4E | |
| SCHEMBL10548744 | 0.78 | MLYCD (0.48) | ALDH1A1SMN1; SMN2LMNAMEN1KMT2A | |
| SCHEMBL10546095 | 0.77 | KMT2A (0.44) | ALDH1A1NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL10546564 | 0.73 | ALDH1A1 (0.51) | ALDH1A1NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL11133367 | 0.72 | HDAC6 (0.55) | ALDH1A1THRATHRBCNR2 | |
| SCHEMBL8472203 | 0.70 | ALDH1A1 (0.54) | ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL10547048 | 0.70 | TP53 (0.48) | ALDH1A1NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL13381405 | 0.70 | ALDH1A1 (0.42) | ALDH1A1THRATHRBSMN1; SMN2LMNA | |
| SCHEMBL19458018 | 0.70 | HSD17B3 (0.55) | ALDH1A1THRATHRBMEN1KMT2A |
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-4814341-A | HISTAMINE H2 ANTAGONISTS | REITER LAWRENCE A (US) | 1989-03-21 | — | — | US | disclosed |