Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 7/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | EGFR | P00533 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | PABPC1 | P11940 | 2/20 | 0.39 |
| ▸ | NSD2 | O96028 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | CDC25B | P30305 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 3/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1346951 | 0.81 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2ADORA2ASTAT3L3MBTL1 | |
| SCHEMBL13241510 | 0.75 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2ADORA2ASTAT3L3MBTL1 | |
| SCHEMBL31544427 | 0.75 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2ADORA2ASTAT3L3MBTL1 | |
| SCHEMBL150811 | 0.73 | HTR6 (0.38) | MEN1KMT2AELANE | |
| SCHEMBL6295690 | 0.73 | KMT2A (0.33) | MEN1KMT2A | |
| SCHEMBL5144369 | 0.71 | KDM4E (0.41) | ALDH1A1SMN1; SMN2L3MBTL1MAPTTDP1 | |
| SCHEMBL11692931 | 0.71 | MYC (0.36) | SMN1; SMN2L3MBTL1NSD2MEN1KMT2A | |
| SCHEMBL5146128 | 0.71 | HSD11B1 (0.45) | ALDH1A1L3MBTL1HSD17B10TSHRNFE2L2 | |
| SCHEMBL7948037 | 0.71 | ADORA2A (0.48) | ALDH1A1SMN1; SMN2ADORA2AL3MBTL1MAPK1 | |
| SCHEMBL9495334 | 0.71 | AKR1B1 (0.41) | ALDH1A1L3MBTL1MEN1KMT2ANFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5498713-A | FIBER-REACTIVE DYES | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-03-12 | — | — | US | disclosed |