Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | BUB1 | O43683 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4337421 | 0.85 | MCL1 (0.46) | MCL1NPC1RAB9APTGESADORA3 | |
| SCHEMBL4344246 | 0.77 | POLB (0.37) | RAB9AMAPTALDH1A1BUB1MEN1 | |
| SCHEMBL4338517 | 0.75 | BUB1 (0.41) | ALDH1A1BUB1HPGDMEN1KMT2A | |
| SCHEMBL4347024 | 0.75 | KDM4E (0.47) | RAB9ASMN1; SMN2MAPTALDH1A1LMNA | |
| SCHEMBL11653596 | 0.69 | SMN1; SMN2 (0.58) | NPC1RAB9ASMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL9719992 | 0.67 | ALOX15 (0.59) | NPC1RAB9ASMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL4346788 | 0.66 | MMP2 (0.41) | SMN1; SMN2MAPTALDH1A1LMNABUB1 | |
| SCHEMBL9720010 | 0.66 | TSHR (0.55) | NPC1RAB9APTGESSMN1; SMN2MAPT | |
| SCHEMBL4332758 | 0.66 | MEN1 (0.57) | SMN1; SMN2MAPTALDH1A1LMNABUB1 | |
| Potassium SCHEMBL4334708 | 0.65 | MEN1 (0.56) | SMN1; SMN2MAPTALDH1A1LMNABUB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501797-B1 | 3-(SUBSTITUTED AMINO)-1H-INDOLE-2-CARBOXYLIC ACID ESTER AND 3-(SUBSTITUTED AMINO)-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID ESTER DERIVATIVES AS INTERLEUKIN-4 GENE EXPRESSION INHIBITORS | AVENTIS PHARMA INC (US) | 2009-08-05 | — | — | EP | claimed |