Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.63 |
| ▸ | RAB9A | P51151 | 4/20 | 0.63 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | TRPV1 | Q8NER1 | 5/20 | 0.56 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7652620 | 0.97 | NPC1 (0.68) | NPC1RAB9AHDAC4HDAC6SMN1; SMN2 | |
| SCHEMBL7647671 | 0.93 | RAB9A (0.59) | NPC1RAB9AHDAC4SMN1; SMN2CYP1A2 | |
| SCHEMBL6785503 | 0.85 | HDAC4 (0.62) | NPC1RAB9AHDAC4HDAC6TRPV1 | |
| SCHEMBL17927246 | 0.84 | HDAC4 (0.65) | NPC1RAB9AHDAC4 | |
| SCHEMBL123652 | 0.83 | NPC1 (0.79) | NPC1RAB9ASMN1; SMN2CYP1A2HPGD | |
| SCHEMBL10210759 | 0.81 | CHRNB2 (0.66) | HDAC4HDAC6SLC6A5KMT2AMEN1 | |
| SCHEMBL520877 | 0.81 | NPC1 (0.82) | NPC1RAB9ASMN1; SMN2CYP1A2HPGD | |
| SCHEMBL28928584 | 0.81 | NPC1 (0.82) | NPC1RAB9ASMN1; SMN2CYP1A2HPGD | |
| SCHEMBL126657 | 0.81 | NPC1 (0.82) | NPC1RAB9ASMN1; SMN2CYP1A2HPGD | |
| SCHEMBL8315644 | 0.80 | HDAC4 (0.47) | NPC1RAB9AHDAC4HDAC6SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6486349-B1 | Amide therapeutics and methods for treating inflammatory bowel disease | CENTAUR PHARMACEUTICALS, INC. | 2002-11-26 | — | — | US | claimed |
| US-6486349-B1 | Amide therapeutics and methods for treating inflammatory bowel disease | CENTAUR PHARMACEUTICALS, INC. | 2002-11-26 | — | — | US | disclosed |