Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | IDO1 | P14902 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30989215 | 0.79 | L3MBTL1 (0.52) | ALDH1A1IDO1POLBKDM4EGAA | |
| SCHEMBL11334176 | 0.78 | ALDH1A1 (0.59) | ALDH1A1IDO1POLBKDM4EGAA | |
| SCHEMBL9214713 | 0.77 | ALDH1A1 (0.68) | ALDH1A1IDO1POLBKDM4EGAA | |
| SCHEMBL11323906 | 0.77 | ALDH1A1 (0.58) | ALDH1A1IDO1POLBKDM4EGAA | |
| SCHEMBL22995206 | 0.76 | ALDH1A1 (0.56) | ALDH1A1IDO1POLBKDM4EGAA | |
| SCHEMBL10636343 | 0.76 | ALDH1A1 (0.66) | ALDH1A1IDO1POLBKDM4EGAA | |
| SCHEMBL11663293 | 0.76 | IDO1 (0.66) | ALDH1A1IDO1POLBKDM4EGAA | |
| SCHEMBL11320932 | 0.76 | ALDH1A1 (0.56) | ALDH1A1IDO1POLBKDM4EGAA | |
| SCHEMBL1070187 | 0.76 | ALDH1A1 (0.56) | ALDH1A1IDO1POLBKDM4EGAA | |
| SCHEMBL8504178 | 0.74 | IDO1 (0.64) | ALDH1A1IDO1POLBKDM4EGAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1200433-B1 | C-6 RING-SUBSTITUTED PYRIDO[1,2-a]BENZIMIDAZOLE DERIVATIVES USEFUL IN TREATING CENTRAL NERVOUS SYSTEM DISORDERS | ORTHO MCNEIL PHARM INC (US) | 2006-03-22 | — | — | EP | disclosed |
| EP-1200433-A1 | C-6 RING-SUBSTITUTED PYRIDO 1,2- i a /i ]BENZIMIDAZOLE DERIVATIVES USEFUL IN TREATING CENTRAL NERVOUS SYSTEM DISORDERS | Ortho-McNeil Pharmaceutical, Inc. (US) | 2002-05-02 | — | — | EP | disclosed |
| US-6358946-B1 | ANTIDEPRESSANTS, ANXIOLYTIC AGENTS, SEDATIVES, MUSCLE RELAXANTS, ANTICONVULSANTS, AND HYPNOSIS AGENTS; SLEEP DISORDER TREATMENT | ORTHO-MCNEIL PHARMACEUTICAL, INC. | 2002-03-19 | — | — | US | disclosed |
| WO-2001009132-A1 | C-6 RING-SUBSTITUTED PYRIDO[1,2-a]BENZIMIDAZOLE DERIVATIVES USEFUL IN TREATING CENTRAL NERVOUS SYSTEM DISORDERS | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2001-02-08 | — | — | WO | disclosed |