Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CG | P48736 | 1/20 | 0.44 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.41 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.41 |
| ▸ | XDH | P47989 | 2/20 | 0.41 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 6/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | SNCA | P37840 | 1/20 | 0.35 |
| ▸ | TLR4 | O00206 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8972432 | 0.90 | LMNA (0.45) | PSMB8XDHMAPTRAB9ALMNA | |
| SCHEMBL9306816 | 0.90 | PIK3CG (0.42) | PIK3CGPSMB8PSMB5XDHNLRP3 | |
| SCHEMBL8972447 | 0.84 | NPC1 (0.42) | PIK3CGMAPTRAB9ALMNAALDH1A1 | |
| SCHEMBL9305516 | 0.82 | TLR4 (0.44) | XDHNLRP3MAPTRAB9ATLR4 | |
| SCHEMBL9305087 | 0.82 | MAPT (0.46) | MAPTRAB9ALMNAALDH1A1ALOX15 | |
| SCHEMBL8972323 | 0.81 | NPC1 (0.42) | PSMB8XDHMAPTRAB9ALMNA | |
| SCHEMBL10888964 | 0.81 | ALDH1A1 (0.42) | MAPTRAB9ALMNAALDH1A1CASP3 | |
| Ammonia Solution, Strong SCHEMBL10865670 | 0.80 | RAB9A (0.41) | PSMB8XDHMAPTRAB9ALMNA | |
| SCHEMBL8972448 | 0.80 | LMNA (0.48) | PSMB8XDHMAPTRAB9ALMNA | |
| SCHEMBL8972635 | 0.80 | TP53 (0.49) | MAPTRAB9AALDH1A1CYP1A2SMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5347008-A | Thio(cyclo) alkanepolycarboxylic acids containing heterocyclic substituents | CIBA-GEIGY CORPORATION (US) | 1994-09-13 | — | — | US | disclosed |
| US-5152929-A | Corrosion inhibitors for water systems | CIBA-GEIGY CORPORATION (US) | 1992-10-06 | — | — | US | disclosed |
| US-4612049-A | BENZOTHI ZOLYL THIO-, BENZIMIDAZOLYLTHIO- OR BENZOXAZOLYLTHIO-SUBSTITUTED CARBOXY ACID | CIBA-GEIGY CORPORATION (US) | 1986-09-16 | — | — | US | disclosed |