Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.41 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | BAD | Q92934 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ALPG | P10696 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5709683 | 0.86 | POLB (0.42) | POLBTDP1PKMCES2CES1 | |
| SCHEMBL6985058 | 0.80 | CES1 (0.46) | NPC1RAB9ASMN1; SMN2PTGS2PLA2G7 | |
| SCHEMBL6986994 | 0.78 | NFE2L2 (0.41) | NPC1RAB9ASMN1; SMN2PTGS2PLA2G7 | |
| SCHEMBL9729472 | 0.75 | NPC1 (0.47) | NPC1RAB9ASMN1; SMN2PTGS2MEN1 | |
| SCHEMBL6312637 | 0.74 | NPC1 (0.48) | NPC1RAB9ASMN1; SMN2NFE2L2MEN1 | |
| SCHEMBL10518218 | 0.74 | NPC1 (0.48) | NPC1RAB9ASMN1; SMN2NFE2L2MEN1 | |
| SCHEMBL8212756 | 0.74 | CES2 (0.48) | NPC1RAB9ASMN1; SMN2PTGS2MEN1 | |
| SCHEMBL25501695 | 0.71 | ESR1 (0.47) | NPC1RAB9ASMN1; SMN2PTGS2MEN1 | |
| SCHEMBL6985545 | 0.71 | ALDH1A1 (0.48) | NPC1RAB9ASMN1; SMN2CES1LMNA | |
| SCHEMBL7940672 | 0.71 | HPGD (0.51) | NPC1RAB9ASMN1; SMN2MEN1POLB |
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-1294695-A2 | SUBSTITUTED DIAMIDE DERIVATIVES USEFUL AS MOTILIN ANTAGONISTS | Ortho-McNeil Pharmaceutical, Inc. (US) | 2003-03-26 | — | — | EP | claimed |
| WO-2001085694-A2 | SUBSTITUTED DIAMIDE DERIVATIVES USEFUL AS MOTILIN ANTAGONISTS | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2001-11-15 | — | — | WO | claimed |
| WO-2015095337-A2 | PYRAZOLO[1,5-a]PYRIMIDINECARBOXAMIDE DERIVATIVES FOR TREATING COGNITIVE IMPAIRMENT | THE ROCKEFELLER UNIVERSITY (US) | 2015-06-25 | — | — | WO | disclosed |