Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NNMT | P40261 | 3/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
| ▸ | CCR5 | P51681 | 1/20 | 0.32 |
| ▸ | CCR8 | P51685 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 2/20 | 0.31 |
| ▸ | NOS2 | P35228 | 2/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.30 |
| ▸ | CDC7 | O00311 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25425630 | 0.80 | NNMT (0.47) | NNMTHTR2AHTR2CHTR2BMEN1 | |
| SCHEMBL25425626 | 0.80 | NNMT (0.47) | NNMTHTR2AHTR2CHTR2BMEN1 | |
| SCHEMBL13507512 | 0.77 | NNMT (0.42) | NNMT | |
| SCHEMBL24126980 | 0.77 | NNMT (0.39) | NNMTHTR2AHTR2CHTR2B | |
| SCHEMBL13485118 | 0.77 | NNMT (0.39) | NNMTHTR2ACREBBPKMT2A | |
| SCHEMBL25794814 | 0.69 | NNMT (0.45) | NNMTMEN1KMT2ANOS3NOS2 | |
| SCHEMBL25795081 | 0.69 | NNMT (0.45) | NNMTMEN1KMT2ANOS3NOS2 | |
| SCHEMBL25794815 | 0.69 | NNMT (0.45) | NNMTMEN1KMT2ANOS3NOS2 | |
| SCHEMBL25789870 | 0.69 | NNMT (0.55) | NNMT | |
| SCHEMBL21974558 | 0.69 | NNMT (0.34) | NNMTCREBBP |
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-2023129512-A1 | BICYCLIC INHIBITORS OF NICOTINAMIDE N-METHYLTRANSFERASE, COMPOSITIONS AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2023-07-06 | — | — | WO | disclosed |
| WO-2023129513-A2 | BICYCLIC HETEROAROMATIC INHIBITORS OF NICOTINAMIDE N-METHYLTRANSFERASE, AND COMPOSITIONS AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2023-07-06 | — | — | WO | disclosed |