Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.68 |
| ▸ | ATM | Q13315 | 2/20 | 0.68 |
| ▸ | MEN1 | O00255 | 1/20 | 0.66 |
| ▸ | CTSB | P07858 | 1/20 | 0.55 |
| ▸ | CTSS | P25774 | 1/20 | 0.55 |
| ▸ | CTSK | P43235 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | ACE | P12821 | 1/20 | 0.45 |
| ▸ | ACACB | O00763 | 4/20 | 0.44 |
| ▸ | ACACA | Q13085 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18011186 | 1.00 | KMT2A (0.68) | KMT2AATMMEN1CTSBCTSS | |
| SCHEMBL18011263 | 0.92 | KMT2A (0.57) | KMT2AATMMEN1CTSBCTSS | |
| SCHEMBL16606611 | 0.92 | KMT2A (0.57) | KMT2AATMMEN1CTSBCTSS | |
| SCHEMBL388983 | 0.90 | KMT2A (0.82) | KMT2AATMMEN1CTSBCTSS | |
| SCHEMBL388984 | 0.90 | KMT2A (0.82) | KMT2AATMMEN1CTSBCTSS | |
| SCHEMBL28057007 | 0.90 | KMT2A (0.82) | KMT2AATMMEN1CTSBCTSS | |
| SCHEMBL25964575 | 0.89 | KMT2A (0.68) | KMT2AATMMEN1MAPK1LMNA | |
| SCHEMBL30309096 | 0.89 | KMT2A (0.68) | KMT2AATMMEN1MAPK1LMNA | |
| SCHEMBL16604349 | 0.89 | KMT2A (0.69) | KMT2AATMMEN1CTSSCTSK | |
| SCHEMBL18093140 | 0.89 | KMT2A (0.69) | KMT2AATMMEN1CTSSCTSK |
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-2015044167-A1 | SUBSTITUTED PHENYLALANINE DERIVATIVES AS MODULATORS OF FACTOR XIA | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2015-04-02 | — | — | WO | disclosed |