Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.39 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.39 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 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 | |
|---|---|---|---|---|
| SCHEMBL6978758 | 0.84 | CHRM2 (0.49) | MAOBKMT2A | |
| SCHEMBL8896665 | 0.80 | TSHR (0.55) | KDM4EALDH1A1HTTTDP1HPGD | |
| SCHEMBL79754 | 0.78 | CALM1 (0.50) | KDM4EALDH1A1TSHR | |
| SCHEMBL23312282 | 0.77 | ALDH1A1 (0.50) | KDM4EALDH1A1HTTTDP1HPGD | |
| SCHEMBL8939741 | 0.77 | KDM4E (0.44) | KDM4EALDH1A1HTTTDP1HPGD | |
| SCHEMBL22550294 | 0.77 | CALM1 (0.55) | KDM4EALDH1A1HTTTDP1HPGD | |
| SCHEMBL9816693 | 0.75 | SRD5A2 (0.58) | KDM4EALDH1A1HTTTDP1HPGD | |
| SCHEMBL3151281 | 0.75 | TAAR1 (0.43) | ALDH1A1MAOBMEN1KMT2A | |
| SCHEMBL6991708 | 0.75 | MAOB (0.48) | HTTSMN1; SMN2MAOB | |
| SCHEMBL3153832 | 0.75 | PNMT (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5516797-A | SUPPRESSING GRAFT REJECTION | VERTEX PHARMACEUTICALS, INCORPORATED (US) | 1996-05-14 | — | — | US | disclosed |
| US-5330993-A | Immunosuppressive compounds | VERTEX PHARMACEUTICALS, INC. (US) | 1994-07-19 | — | — | US | disclosed |