Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7279578 | 0.83 | MAPT (0.46) | GPR88ALDH1A1TSHRLMNAPOLB | |
| SCHEMBL7270481 | 0.81 | GPR88 (0.41) | GPR88ALDH1A1TSHRLMNAPOLB | |
| SCHEMBL1890430 | 0.77 | ALDH1A1 (0.50) | ALDH1A1TSHRLMNAKDM4EHTT | |
| SCHEMBL6436022 | 0.75 | ATM (0.59) | ALDH1A1TSHRLMNAKDM4ERAB9A | |
| SCHEMBL6436027 | 0.75 | ATM (0.59) | ALDH1A1TSHRLMNAKDM4ERAB9A | |
| SCHEMBL7407225 | 0.72 | MMP13 (0.48) | ALDH1A1TSHRLMNA | |
| SCHEMBL12482203 | 0.71 | ROCK1 (0.51) | GPR88ALDH1A1TSHRLMNA | |
| SCHEMBL28911342 | 0.71 | CTSK (0.49) | ALDH1A1TSHRLMNARAB9AHTT | |
| SCHEMBL28911341 | 0.71 | CTSK (0.49) | ALDH1A1TSHRLMNARAB9AHTT | |
| SCHEMBL29858123 | 0.71 | CYP1A2 (0.45) | ALDH1A1KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0839798-A2 | Intermediates for preparating non-peptide retroviral protease inhibitors | ABBOTT LABORATORIES (US) | 1998-05-06 | — | — | EP | disclosed |
| US-5670675-A | Retroviral protease inhibiting compounds | ABBOTT LABORATORIES (US) | 1997-09-23 | — | — | US | disclosed |
| US-5142056-A | Human immunodeficiency virus protease inhibitor | ABBOTT LABORATORIES (US) | 1992-08-25 | — | — | US | disclosed |
| EP-0402646-A1 | Retroviral protease inhibiting compounds | ABBOTT LABORATORIES (US) | 1990-12-19 | — | — | EP | disclosed |