Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 2/20 | 0.44 |
| ▸ | NNMT | P40261 | 3/20 | 0.43 |
| ▸ | ABL1 | P00519 | 3/20 | 0.40 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 6/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | ACACA | Q13085 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 4/20 | 0.39 |
| ▸ | WNT1 | P04628 | 3/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
| ▸ | CLK3 | P49761 | 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 | |
|---|---|---|---|---|
| SCHEMBL2671513 | 0.83 | HCAR3 (0.60) | HCAR3NNMTUSP30DYRK1AACACB | |
| SCHEMBL2671631 | 0.81 | ALOX15 (0.49) | HCAR3NNMTDYRK1AALDH1A1GSK3B | |
| SCHEMBL4137382 | 0.79 | NNMT (0.44) | HCAR3NNMTUSP30DYRK1AACACB | |
| SCHEMBL2671618 | 0.77 | HCAR3 (0.60) | HCAR3NNMTABL1DYRK1AACACB | |
| SCHEMBL4404500 | 0.77 | NCF1 (0.44) | HCAR3NNMTNPC1ALDH1A1RAB9A | |
| SCHEMBL12647584 | 0.76 | KDM4D (0.42) | HCAR3NPC1RAB9ASMN1; SMN2ATM | |
| SCHEMBL23048823 | 0.75 | NNMT (0.34) | HCAR3NNMTABL1USP30DYRK1A | |
| SCHEMBL21573033 | 0.75 | ALDH1A1 (0.59) | NPC1ALDH1A1RAB9ASMN1; SMN2ATM | |
| SCHEMBL23740771 | 0.74 | DYRK1A (0.36) | HCAR3NNMTABL1USP30DYRK1A | |
| SCHEMBL16167687 | 0.73 | NNMT (0.44) | HCAR3NNMTABL1ACACBACACA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012056372-A1 | N1/N2-LACTAM ACETYL-CoA CARBOXYLASE INHIBITORS | PFIZER INC. (US) | 2012-05-03 | — | — | WO | disclosed |