Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | SCD | O00767 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 7/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4458448 | 1.00 | NPC1 (0.43) | NPC1RAB9ASMN1; SMN2TP53CTSS | |
| SCHEMBL4468902 | 0.84 | NPC1 (0.39) | NPC1RAB9ASMN1; SMN2TP53CTSS | |
| SCHEMBL4457420 | 0.81 | NPC1 (0.50) | NPC1RAB9ASMN1; SMN2TP53CTSS | |
| SCHEMBL4464697 | 0.81 | NPC1 (0.50) | NPC1RAB9ASMN1; SMN2TP53CTSS | |
| SCHEMBL4469735 | 0.81 | RAB9A (0.40) | NPC1RAB9ASMN1; SMN2TP53GAA | |
| SCHEMBL4469739 | 0.81 | RAB9A (0.40) | NPC1RAB9ASMN1; SMN2TP53GAA | |
| Hydrochloric Acid SCHEMBL4456761 | 0.80 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2TP53CTSS | |
| Hydrochloric Acid SCHEMBL4456756 | 0.80 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2TP53CTSS | |
| SCHEMBL13408963 | 0.80 | CTSS (0.46) | NPC1RAB9ASMN1; SMN2TP53CTSS | |
| SCHEMBL14195628 | 0.80 | CTSS (0.46) | NPC1RAB9ASMN1; SMN2TP53CTSS |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009151744-A1 | S-NITROSOMERCAPTO COMPOUNDS AND RELATED DERIVATIVES | GALLEON PHARMACEUTICALS, INC. (US) | 2009-12-17 | — | — | WO | claimed |
| WO-2009151744-A1 | S-NITROSOMERCAPTO COMPOUNDS AND RELATED DERIVATIVES | GALLEON PHARMACEUTICALS, INC. (US) | 2009-12-17 | — | — | WO | disclosed |