Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.61 |
| ▸ | RAB9A | P51151 | 4/20 | 0.61 |
| ▸ | HPGD | P15428 | 3/20 | 0.61 |
| ▸ | MAPT | P10636 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | USP2 | O75604 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.61 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.61 |
| ▸ | RELA | Q04206 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | CBFB | Q13951 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL9304866 | 0.87 | MAPT (0.49) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL12909170 | 0.82 | ALDH1A1 (0.62) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL1748047 | 0.81 | NPC1 (0.58) | NPC1RAB9AHPGDALDH1A1KMT2A | |
| SCHEMBL10966414 | 0.81 | TYMS (0.63) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL917239 | 0.81 | NPC1 (0.61) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL17292671 | 0.79 | NPC1 (0.59) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL6759192 | 0.78 | MEN1 (0.79) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL9305034 | 0.77 | CBFB (0.56) | NPC1RAB9AHPGDALDH1A1KMT2A | |
| SCHEMBL10268154 | 0.77 | POLB (0.67) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL7592744 | 0.77 | RAB9A (0.97) | NPC1RAB9AHPGDMAPTALDH1A1 |
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 |
| EP-0129506-A2 | Heterocyclically substituted thio(cyclo)alkane polycarboxylic acids | CIBA-GEIGY AG (CH) | 1984-12-27 | — | — | EP | disclosed |