Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 1/20 | 0.72 |
| ▸ | PTGS2 | P35354 | 8/20 | 0.67 |
| ▸ | PTGS1 | P23219 | 7/20 | 0.67 |
| ▸ | CA2 | P00918 | 9/20 | 0.64 |
| ▸ | CA1 | P00915 | 8/20 | 0.64 |
| ▸ | CA9 | Q16790 | 8/20 | 0.62 |
| ▸ | CA12 | O43570 | 6/20 | 0.62 |
| ▸ | CA7 | P43166 | 4/20 | 0.62 |
| ▸ | CA4 | P22748 | 3/20 | 0.62 |
| ▸ | MAOA | P21397 | 2/20 | 0.62 |
| ▸ | MAOB | P27338 | 1/20 | 0.60 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | CA6 | P23280 | 1/20 | 0.56 |
| ▸ | CA5A | P35218 | 1/20 | 0.56 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | AGO2 | Q9UKV8 | 1/20 | 0.56 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL283919 | 0.97 | SOS1 (0.75) | SOS1PTGS2PTGS1CA2CA1 | |
| SCHEMBL31527705 | 0.97 | SOS1 (0.75) | SOS1PTGS2PTGS1CA2CA1 | |
| Iodide SCHEMBL28540305 | 0.95 | SOS1 (0.72) | SOS1PTGS2PTGS1CA2CA1 | |
| Hydrochloric Acid SCHEMBL29876112 | 0.95 | SOS1 (0.72) | SOS1PTGS2PTGS1CA2CA1 | |
| SCHEMBL1430142 | 0.90 | CA2 (0.76) | SOS1PTGS2PTGS1CA2CA1 | |
| SCHEMBL28385356 | 0.88 | SOS1 (0.64) | SOS1PTGS2PTGS1CA2CA1 | |
| Sulfanilamide SCHEMBL27994963 | 0.88 | CA2 (0.77) | SOS1PTGS2PTGS1CA2CA1 | |
| SCHEMBL27510169 | 0.84 | SOS1 (1.00) | SOS1PTGS2PTGS1CA2CA1 | |
| SCHEMBL202948 | 0.83 | CA2 (0.81) | CA2CA1CA9CA12CA7 | |
| Benzenesulfonamide SCHEMBL28328141 | 0.83 | PTGS2 (0.65) | SOS1PTGS2PTGS1CA2CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6030976-A | SELECTIVE AFFINITY TO 5HT-6 RECEPTORS; CENTRAL NERVOUS SYSTEM DISORDERS; ALZHEIMER'S DISEASE, PSYCHOSES, SCHIZOPHRENIA, MANIC DEPRESSIONS, MEMORY DISORDERS, PARKINSON'S DISEASE, AMYOTROPHIC LATERAL SCLEROSIS AND HUNTINGTON'S DISEASE | HOFFMAN-LA ROCHE INC. (US) | 2000-02-29 | — | — | US | disclosed |
| US-5998665-A | THERAPY FOR NERVOUS SYSTEM DISORDERS | HOFFMANN-LA ROCHE INC. (US) | 1999-12-07 | — | — | US | disclosed |
| US-5939451-A | INDOL-4-YL-BENZENESULFONAMIDES AS ACTIVE MATERIAL TREATING MALARIA, BACTERIAL INFECTION, NEUROLOGICAL DISORDERS | HOFFMANN-LA ROCHE INC. (US) | 1999-08-17 | — | — | US | disclosed |
| US-5932599-A | 4-AMINO-N-(PYRIDINYL-4-YL)-BENZENESULFONAMIDES AS ACTIVE MATERIAL TREATING MALARIA, BACTERIAL INFECTION, NEUROLOGICAL DISORDERS | HOFFMANN-LA ROCHE INC. (US) | 1999-08-03 | — | — | US | disclosed |