Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | NAMPT | P43490 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.42 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28766934 | 0.88 | CFTR (0.48) | MAOBCHRM1LMNATRPV1EPHX2 | |
| SCHEMBL27675189 | 0.88 | GRIK1 (0.51) | RAB9ALMNACREBBPMAPTKMT2A | |
| SCHEMBL27693487 | 0.88 | LMNA (0.51) | MAOBCHRM1LMNACREBBPSMN1; SMN2 | |
| SCHEMBL27675315 | 0.87 | MEN1 (0.44) | NAMPTRAB9ALMNASMN1; SMN2KDM4E | |
| SCHEMBL27675384 | 0.87 | CHRM1 (0.49) | MAOBCHRM1LMNASMN1; SMN2KDM4E | |
| SCHEMBL27693562 | 0.85 | MAOB (0.51) | MAOBCHRM1NAMPTTRPV1EPHX2 | |
| SCHEMBL27693550 | 0.85 | NTRK1 (0.43) | LMNAS1PR1S1PR3CREBBP | |
| SCHEMBL27693544 | 0.85 | CREBBP (0.42) | CHRM1LMNAS1PR1S1PR3CREBBP | |
| SCHEMBL28763086 | 0.84 | CHRM1 (0.46) | MAOBCHRM1LMNAS1PR1S1PR3 | |
| SCHEMBL28766931 | 0.84 | CHRM1 (0.52) | MAOBCHRM1NPC1LMNAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-101006076-B | Modulators of ATP-binding cassette transporters | VERTEX PHARMA | 2010-09-29 | — | — | CN | disclosed |
| CN-101006076-A | Modulators of ATP-binding cassette transporters | VERTEX PHARMA (US) | 2007-07-25 | — | — | CN | disclosed |