Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | BCL9 | O00512 | 1/20 | 0.49 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.40 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.40 |
| ▸ | PTPN22 | Q9Y2R2 | 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 | |
|---|---|---|---|---|
| SCHEMBL8815110 | 0.90 | HTR2A (0.55) | HTR2ABCL9CTNNB1SMN1; SMN2MAPT | |
| SCHEMBL9140032 | 0.85 | HTR2A (0.57) | HTR2ABCL9CTNNB1SMN1; SMN2MAPT | |
| SCHEMBL19978980 | 0.84 | HTR2A (0.56) | HTR2ABCL9CTNNB1SMN1; SMN2MAPT | |
| SCHEMBL4112112 | 0.82 | HTR2A (0.74) | HTR2ABCL9CTNNB1SMN1; SMN2MAPT | |
| SCHEMBL17084531 | 0.81 | HTR2A (0.63) | HTR2ABCL9CTNNB1SMN1; SMN2MAPT | |
| SCHEMBL25378334 | 0.81 | ALDH1A1 (0.51) | SMN1; SMN2MAPTALDH1A1POLBKMT2A | |
| SCHEMBL6396644 | 0.81 | HTR2A (0.65) | HTR2ABCL9CTNNB1SMN1; SMN2MAPT | |
| Water SCHEMBL10938430 | 0.81 | HTR2A (0.73) | HTR2ABCL9CTNNB1SMN1; SMN2MAPT | |
| Water SCHEMBL10938437 | 0.81 | HTR2A (0.73) | HTR2ABCL9CTNNB1SMN1; SMN2MAPT | |
| SCHEMBL9141672 | 0.80 | HTR2A (0.55) | HTR2ABCL9CTNNB1SMN1; SMN2MAPT |
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-5453434-A | Ocular hypotensive agents, treatment of glaucoma | ALLERGAN, INC. (US) | 1995-09-26 | — | — | US | disclosed |
| EP-0646598-A1 | New pseudopeptides with antiviral activity containing valine | BAYER AG (DE) | 1995-04-05 | — | — | EP | disclosed |