Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.69 |
| ▸ | RAB9A | P51151 | 1/20 | 0.69 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.60 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | HTR1A | P08908 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6085154 | 0.84 | NPC1 (0.82) | NPC1RAB9AHDAC3HDAC1SMN1; SMN2 | |
| SCHEMBL5020898 | 0.83 | NPC1 (0.65) | NPC1RAB9AHDAC3HDAC1SMN1; SMN2 | |
| SCHEMBL27832987 | 0.82 | NPC1 (0.64) | NPC1RAB9AHDAC3HDAC1SMN1; SMN2 | |
| SCHEMBL7453913 | 0.82 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2HTR1APOLB | |
| SCHEMBL6698774 | 0.81 | NPC1 (0.70) | NPC1RAB9AHDAC3HDAC1SMN1; SMN2 | |
| SCHEMBL2235021 | 0.81 | NPC1 (0.62) | NPC1RAB9AHDAC3HDAC1SMN1; SMN2 | |
| SCHEMBL2235004 | 0.81 | NPC1 (0.62) | NPC1RAB9AHDAC3HDAC1SMN1; SMN2 | |
| SCHEMBL16411605 | 0.80 | NPC1 (0.60) | NPC1RAB9AHDAC3HDAC1SMN1; SMN2 | |
| SCHEMBL478989 | 0.78 | LMNA (0.59) | LMNAALDH1A1HPGD | |
| SCHEMBL1769500 | 0.77 | NPC1 (0.64) | NPC1RAB9AHDAC3HDAC1SMN1; 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 |
|---|---|---|---|---|---|---|---|
| EP-2501715-A1 | TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVTY | Polyphor Ag (CH) | 2012-09-26 | — | — | EP | disclosed |
| WO-2011060937-A1 | TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVTY | POLYPHOR AG (CH) | 2011-05-26 | — | — | WO | disclosed |
| US-6020366-A | Butyric acid matrix metalloproteinase inhibitors | WARNER-LAMBERT COMPANY (US) | 2000-02-01 | — | — | US | disclosed |