Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.42 |
| ▸ | CTSD | P07339 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | DDX3X | O00571 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ASPH | Q12797 | 1/20 | 0.41 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.41 |
| ▸ | P2RX1 | P51575 | 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 | |
|---|---|---|---|---|
| SCHEMBL28102854 | 0.83 | TSHR (0.51) | TSHRCDK2KCNMA1CTSDKDM4E | |
| SCHEMBL1554426 | 0.81 | TSHR (0.63) | TSHRCDK2KCNMA1CTSDKDM4E | |
| SCHEMBL5110430 | 0.79 | TSHR (0.59) | TSHRCDK2KCNMA1CTSDKDM4E | |
| SCHEMBL11138425 | 0.79 | TSHR (0.55) | TSHRCDK2KCNMA1CTSDKDM4E | |
| SCHEMBL11522354 | 0.78 | TSHR (0.49) | TSHRCDK2KCNMA1CTSDKDM4E | |
| SCHEMBL3035419 | 0.76 | CDK2 (0.59) | TSHRCDK2KCNMA1CTSDKDM4E | |
| SCHEMBL4609558 | 0.76 | ALDH1A1 (0.54) | TSHRCDK2KCNMA1CTSDKDM4E | |
| SCHEMBL305239 | 0.75 | TSHR (0.63) | TSHRCDK2KCNMA1CTSDKDM4E | |
| SCHEMBL7766271 | 0.75 | TSHR (0.51) | TSHRCDK2KCNMA1KDM4EMEN1 | |
| SCHEMBL7760598 | 0.75 | TSHR (0.51) | TSHRCDK2KCNMA1KDM4EMEN1 |
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-4160015-A | 2,4,6-Triiodobenzoic acid derivatives and their use as x-ray contrast agents | MALLINCKRODT, INC. (US) | 1979-07-03 | — | — | US | disclosed |
| US-4125599-A | 2,4,6-TRIIODO-AMIDO-BENZOIC ACIDS | MALLINCKRODT, INC. (US) | 1978-11-14 | — | — | US | disclosed |