Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PADI4 | Q9UM07 | 8/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 3/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | TTK | P33981 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL8068010 | 0.92 | PADI4 (0.43) | PADI4NPC1RAB9ATDO2IDO1 | |
| SCHEMBL8073308 | 0.86 | IP6K1 (0.41) | NPC1RAB9AMAPTALDH1A1TTK | |
| SCHEMBL8073292 | 0.86 | IP6K1 (0.41) | NPC1RAB9AMAPTALDH1A1TTK | |
| SCHEMBL8069062 | 0.83 | IP6K1 (0.46) | PADI4NPC1RAB9AMEN1MAPT | |
| SCHEMBL8069058 | 0.83 | IP6K1 (0.46) | PADI4NPC1RAB9AMEN1MAPT | |
| SCHEMBL7825535 | 0.80 | KIF11 (0.43) | TTK | |
| SCHEMBL8058054 | 0.80 | ALDH1A1 (0.41) | NPC1RAB9AMEN1MAPTKMT2A | |
| SCHEMBL8058059 | 0.80 | ALDH1A1 (0.41) | NPC1RAB9AMEN1MAPTKMT2A | |
| SCHEMBL7825711 | 0.79 | CCNB2 (0.37) | — | |
| SCHEMBL7825041 | 0.79 | CCNB2 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2000239260-A | PRODUCTION OF OPTICALLY ACTIVE 2-PIPERAZINECARBOXYLIC ACID | KOEI CHEM CO LTD | 2000-09-05 | — | — | JP | disclosed |
| US-6093714-A | AN ANTIALLERGENS FOR TREATMENT AND PREVENTION OF BRONCHIAL ASTHMA, ECZEMA, HIVES, ALLERGIC GASTROINTESTINAL TROUBLES, ALLERGIC RHINITIS, ALLERGIC CONJUNCTIVITIS | MEIJI SEIKA KAISHA, LTD. (JP) | 2000-07-25 | — | — | US | disclosed |