Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SOS1 | Q07889 | 3/20 | 0.40 |
| ▸ | IKBKB | O14920 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | GOT1 | P17174 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | MPO | P05164 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8404453 | 0.77 | C1S (0.43) | KDM4ESMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL14611339 | 0.76 | NPC1 (0.67) | KDM4ESMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL18630252 | 0.74 | C1S (0.41) | KDM4ESMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL8233360 | 0.74 | C1S (0.63) | KDM4ECYP1A2ALDH1A1LMNAC1S | |
| SCHEMBL8297790 | 0.73 | WNT3A (0.41) | KDM4EMEN1KMT2AIKBKBCYP1A2 | |
| SCHEMBL3753939 | 0.73 | TP53 (0.48) | MEN1KMT2ATP53 | |
| SCHEMBL7071832 | 0.71 | C1S (0.39) | KDM4ESMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL14418576 | 0.71 | MAPK14 (0.47) | MAPK14KDM4ESMN1; SMN2NPC1RAB9A | |
| SCHEMBL25857289 | 0.69 | LATS1 (0.41) | KDM4ESMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL3754272 | 0.68 | ALDH1A1 (0.46) | KDM4ESMN1; SMN2NPC1RAB9AMAPT |
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-2004082687-A1 | LACTAM-CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-09-30 | — | — | WO | disclosed |