Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27947665 | 0.86 | TDP1 (0.55) | TDP1MAPTALDH1A1MEN1POLB | |
| SCHEMBL2929031 | 0.85 | TDP1 (0.62) | TDP1MAPTALDH1A1MEN1POLB | |
| SCHEMBL30989211 | 0.85 | TDP1 (0.62) | TDP1MAPTALDH1A1MEN1POLB | |
| SCHEMBL12798874 | 0.85 | TDP1 (0.62) | TDP1MAPTALDH1A1MEN1POLB | |
| SCHEMBL31423774 | 0.83 | TDP1 (0.60) | TDP1MAPTALDH1A1MEN1POLB | |
| SCHEMBL11079242 | 0.83 | TDP1 (0.60) | TDP1MAPTALDH1A1MEN1POLB | |
| SCHEMBL7472630 | 0.82 | TSHR (0.50) | TDP1MAPTALDH1A1POLBCYP3A4 | |
| SCHEMBL1069671 | 0.81 | TSHR (0.59) | TDP1MAPTALDH1A1MEN1POLB | |
| SCHEMBL11292592 | 0.81 | TDP1 (0.58) | TDP1MAPTALDH1A1MEN1POLB | |
| Hydrochloric Acid SCHEMBL7368798 | 0.81 | TDP1 (0.58) | TDP1MAPTALDH1A1MEN1POLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015057963-A1 | FGFR4 INHIBITORS | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2015-04-23 | — | — | WO | disclosed |
| CN-1110685-A | Nitrogen-containing spiro ring | MERCK & CO INC (US) | 1995-10-25 | — | — | CN | disclosed |
| CN-1053613-A | Nitrogen-containing spiro ring | MERCK & CO INC (US) | 1991-08-07 | — | — | CN | disclosed |