Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | KRAS | P01116 | 2/20 | 0.40 |
| ▸ | TUBB1 | Q9H4B7 | 5/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 4/20 | 0.38 |
| ▸ | TUBB | P07437 | 4/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 4/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 4/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 4/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 4/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 4/20 | 0.38 |
| ▸ | TUBB2A | Q13885 | 4/20 | 0.38 |
| ▸ | TUBB8 | Q3ZCM7 | 4/20 | 0.38 |
| ▸ | TUBA3E | Q6PEY2 | 4/20 | 0.38 |
| ▸ | TUBA1A | Q71U36 | 4/20 | 0.38 |
| ▸ | TUBA1C | Q9BQE3 | 4/20 | 0.38 |
| ▸ | TUBB6 | Q9BUF5 | 4/20 | 0.38 |
| ▸ | TUBB2B | Q9BVA1 | 4/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7493742 | 0.81 | TUBB1 (0.44) | MEN1KMT2AKRASTUBB1TUBB4A | |
| SCHEMBL7077267 | 0.78 | CYP1A2 (0.46) | MEN1KMT2ATUBB1TUBB4ATUBB | |
| SCHEMBL7081113 | 0.76 | KMT2A (0.45) | MEN1KMT2AKRASTUBB1TUBB4A | |
| SCHEMBL1957643 | 0.74 | NFE2L2 (0.43) | MEN1KMT2AKRASALDH1A1 | |
| SCHEMBL6239908 | 0.72 | SMN1; SMN2 (0.53) | MEN1KMT2AKDM4EPOLBMAPT | |
| SCHEMBL5205282 | 0.72 | CA12 (0.49) | MEN1KMT2AABCB1KDM4EPOLB | |
| SCHEMBL7490908 | 0.72 | KDM4E (0.36) | MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL724406 | 0.71 | PTGS2 (0.59) | MEN1KMT2ATUBB1TUBB4ATUBB | |
| SCHEMBL7081851 | 0.69 | TAAR1 (0.57) | MEN1KMT2AALDH1A1 | |
| SCHEMBL7465002 | 0.69 | ALDH1A1 (0.42) | MEN1KMT2AKRASTUBB1POLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1196384-A4 | 1-(AROMATIC- OR HETEROAROMATIC-SUBSTITUTED)-3-(HETEROAROMATIC SUBSTITUTED)-1,3-PROPANEDIONES AND USES THEREOF | MERCK & CO INC (US) | 2002-10-23 | — | — | EP | disclosed |
| EP-1196384-A1 | 1-(AROMATIC- OR HETEROAROMATIC-SUBSTITUTED)-3-(HETEROAROMATIC SUBSTITUTED)-1,3-PROPANEDIONES AND USES THEREOF | Merck & Co., Inc. (US) | 2002-04-17 | — | — | EP | disclosed |
| WO-2001000578-A1 | 1-(AROMATIC- OR HETEROAROMATIC-SUBSTITUTED)-3-(HETEROAROMATIC SUBSTITUTED)-1,3-PROPANEDIONES AND USES THEREOF | MERCK & CO., INC. (US) | 2001-01-04 | — | — | WO | disclosed |