Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL7398378 | 0.81 | CYP3A4 (0.46) | KMT2AALDH1A1LMNAKDM4EL3MBTL1 | |
| SCHEMBL7979052 | 0.80 | TP53 (0.39) | TDP1SLC6A2SLC6A3KMT2AALDH1A1 | |
| SCHEMBL28396741 | 0.78 | ALDH1A1 (0.55) | TDP1SLC6A2SLC6A3KMT2AALDH1A1 | |
| SCHEMBL7392898 | 0.78 | TDP1 (0.54) | TDP1SLC6A2SLC6A3KMT2AALDH1A1 | |
| SCHEMBL7991389 | 0.77 | L3MBTL1 (0.35) | TDP1SLC6A2SLC6A3KMT2AALDH1A1 | |
| SCHEMBL7631721 | 0.77 | ALDH1A1 (0.58) | TDP1SLC6A2SLC6A3KMT2AALDH1A1 | |
| SCHEMBL3643355 | 0.76 | MTNR1A (0.41) | TDP1KMT2AKDM4ECYP1A2CYP2D6 | |
| SCHEMBL7991480 | 0.76 | MMP3 (0.50) | KMT2AALDH1A1LMNAL3MBTL1ATM | |
| SCHEMBL16131300 | 0.76 | KMT2A (0.56) | TDP1SLC6A2SLC6A3KMT2AALDH1A1 | |
| SCHEMBL9748801 | 0.76 | LTA4H (0.50) | LTA4HEPHX2L3MBTL1NPC1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-6288261-B1 | DRUGS FOR INHIBITION OF ENZYMES | ABBOTT LABORATORIES | 2001-09-11 | — | — | US | disclosed |
| WO-2000037433-A1 | INHIBITORS OF MATRIX METALLOPROTEINASES | ABBOTT LABORATORIES (US) | 2000-06-29 | — | — | WO | disclosed |