Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.60 |
| ▸ | BCL9 | O00512 | 1/20 | 0.45 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.40 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.40 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL7365417 | 0.87 | HTR2A (0.49) | HTR2ABCL9CTNNB1GAAPKM | |
| SCHEMBL5827968 | 0.84 | HTR2A (0.80) | HTR2ABCL9CTNNB1GAAMAOB | |
| SCHEMBL14621621 | 0.81 | HTR2A (0.74) | HTR2ABCL9CTNNB1GAAMAOB | |
| SCHEMBL1714950 | 0.81 | HTR2A (0.70) | HTR2ABCL9CTNNB1RAB9AKMT2A | |
| SCHEMBL8810198 | 0.80 | CA12 (0.55) | MAOB | |
| SCHEMBL23042226 | 0.78 | HTR2A (0.67) | HTR2ABCL9CTNNB1GAAMAOB | |
| SCHEMBL6648196 | 0.78 | HTR2A (0.70) | HTR2ABCL9CTNNB1GAAMAOB | |
| SCHEMBL6594172 | 0.78 | HTR2A (0.74) | HTR2ABCL9CTNNB1GAAMAOB | |
| SCHEMBL4112112 | 0.78 | HTR2A (0.74) | HTR2ABCL9CTNNB1GAAMAOB | |
| SCHEMBL20480867 | 0.78 | HTR2A (0.70) | HTR2ABCL9CTNNB1GAAMAOB |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0486948-B1 | Retroviral protease inhibiting compounds | ABBOTT LAB (US) | 2000-10-04 | — | — | EP | disclosed |
| EP-0997459-A1 | Intermediates for preparing retroviral protease inhibiting compounds | Abbott Laboratories (US) | 2000-05-03 | — | — | EP | disclosed |
| US-5837873-A | PROTECTED OXYDIAMINES | ABBOTT LABORATORIES (US) | 1998-11-17 | — | — | US | disclosed |
| US-5648497-A | Retroviral protease inhibiting compounds | ABBOTT LABORAOTRIES (US) | 1997-07-15 | — | — | US | disclosed |
| EP-0486948-A2 | Retroviral protease inhibiting compounds | ABBOTT LABORATORIES (US) | 1992-05-27 | — | — | EP | disclosed |