Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.31 |
| ▸ | RAB9A | P51151 | 3/20 | 0.31 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.31 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.31 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.31 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7974020 | 0.77 | ALDH1A1 (0.32) | NPC1RAB9AALDH1A1TP53HPGD | |
| Trifluoroacetic Acid SCHEMBL7973892 | 0.76 | TBXAS1 (0.34) | NPC1RAB9APLA2G1BATG4BITGB3 | |
| Hydrochloric Acid SCHEMBL6990489 | 0.75 | TBXAS1 (0.46) | NPC1RAB9APLA2G1BATG4BITGB3 | |
| Hydrochloric Acid SCHEMBL6998111 | 0.71 | PDK1 (0.46) | NPC1RAB9APLA2G1BATG4BALDH1A1 | |
| SCHEMBL19277248 | 0.64 | GHSR (0.46) | — | |
| SCHEMBL6989880 | 0.63 | TBXAS1 (0.39) | NPC1RAB9AALDH1A1TBXAS1TP53 | |
| Trifluoroacetic Acid SCHEMBL29977305 | 0.61 | ALDH1A1 (0.61) | NPC1RAB9AALDH1A1TP53HPGD | |
| SCHEMBL1662124 | 0.61 | THRB (0.39) | — | |
| Trifluoroacetic Acid SCHEMBL7976860 | 0.61 | MTNR1A (0.32) | — | |
| Hydrochloric Acid SCHEMBL6998122 | 0.61 | PDK1 (0.47) | NPC1RAB9AALDH1A1HPGDMAPK1 |
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-6274619-B1 | FUSED AMIDINO TYPE COMPOUNDS SUCH AS 4-(N-BUTYLCARBAMOYLMETHYLIDENE)-2-AMIDINO-4,5,6,7-TETRAHYDROBE NZO(B)THIOPHENE | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-08-14 | — | — | US | disclosed |
| US-6093710-A | AN ENZYME INHIBITOR TREATING ANGIOGENESIS, ARTHRITIS, INFLAMMATION, METASTASIS, OSTEOPOROSIS, TUMORSANGIOGENESIS-DEPENDENT RETINOPATHIES, CONTRACEPTIVE | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-07-25 | — | — | US | disclosed |