Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 4/20 | 0.70 |
| ▸ | MAPT | P10636 | 11/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | RECQL | P46063 | 2/20 | 0.55 |
| ▸ | MITF | O75030 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | KDM4A | O75164 | 1/20 | 0.53 |
| ▸ | KDM4B | O94953 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 6/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11663744 | 1.00 | VCAM1 (0.70) | VCAM1MAPTRAB9ARECQLMITF | |
| SCHEMBL560001 | 0.82 | VCAM1 (1.00) | VCAM1MAPTRAB9ARECQLMITF | |
| SCHEMBL560425 | 0.81 | VCAM1 (0.67) | VCAM1MAPTRAB9ARECQLMITF | |
| SCHEMBL560424 | 0.81 | VCAM1 (0.67) | VCAM1MAPTRAB9ARECQLMITF | |
| SCHEMBL23891778 | 0.80 | VCAM1 (0.53) | VCAM1MAPTMITFNPSR1KDM4A | |
| SCHEMBL4309330 | 0.80 | VCAM1 (0.65) | VCAM1MAPTRAB9ARECQLMITF | |
| SCHEMBL4309326 | 0.80 | VCAM1 (0.65) | VCAM1MAPTRAB9ARECQLMITF | |
| SCHEMBL11681621 | 0.78 | VCAM1 (0.61) | VCAM1MAPTRAB9ARECQLMITF | |
| SCHEMBL27317418 | 0.78 | VCAM1 (0.61) | VCAM1MAPTRAB9ARECQLMITF | |
| SCHEMBL11681617 | 0.78 | VCAM1 (0.61) | VCAM1MAPTRAB9ARECQLMITF |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2091527-B1 | SULFIDE, SULFOXIDE AND SULFONE CHALCONE ANALOGUES, DERIVATIVES THEREOF AND THERAPEUTIC USES THEREOF | UNIV TEMPLE (US) | 2016-03-23 | — | — | EP | disclosed |
| US-5123955-A | Herbicides, chloro and tetrahydrophthalimido-substituted phenyl | PLATH PETER (DE) | 1992-06-23 | — | — | US | disclosed |
| US-4933001-A | HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1990-06-12 | — | — | US | disclosed |
| US-4125563-A | Process for making nitroarylacetylenes and nitroarylaldehydes | HUGHES AIRCRAFT COMPANY (US) | 1978-11-14 | — | — | US | disclosed |
| US-4087549-A | Sulphonic acid containing indenyl derivatives | MERCK & CO., INC. (US) | 1978-05-02 | — | — | US | disclosed |