Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 7/20 | 0.49 |
| ▸ | HTR2A | P28223 | 3/20 | 0.43 |
| ▸ | HTR2C | P28335 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8527647 | 0.90 | NOTUM (0.45) | NOTUMHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL8785820 | 0.86 | NOTUM (0.51) | NOTUMHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL8530059 | 0.85 | HTR2A (0.57) | NOTUMHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL21469281 | 0.78 | NOTUM (0.44) | NOTUMHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL21469162 | 0.78 | NOTUM (0.49) | NOTUMHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL21469204 | 0.77 | NOTUM (0.49) | NOTUMHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL6099890 | 0.77 | NOTUM (0.54) | NOTUMKDM4EALDH1A1HPGDCYP11B2 | |
| SCHEMBL21469170 | 0.76 | NOTUM (0.48) | NOTUMHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL21469273 | 0.76 | NOTUM (0.42) | NOTUMHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL6099529 | 0.76 | NOTUM (0.59) | NOTUMKDM4EALDH1A1HPGDCYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5834494-A | SEROTONIN 5HT2B/2C RECEPTOR ANTAGONISTS; CNS NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS; IRRITABLE BOWEL SYNDROME | SMITHKLINE BEECHAM P.L.C. (GB) | 1998-11-10 | — | — | US | disclosed |
| EP-0707581-B1 | INDOLINE DERIVATIVES AS 5HT2C ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1997-02-26 | — | — | EP | disclosed |
| EP-0707581-A1 | INDOLINE DERIVATIVES AS 5HT 2C? ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1996-04-24 | — | — | EP | disclosed |
| WO-1995001976-A1 | INDOLINE DERIVATIVES AS 5HT2C ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-01-19 | — | — | WO | disclosed |